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Compound Summary

nimodipine

Compound Information

nimodipine

Compound Name:	nimodipine
Compound CID:	4497
Synonyms:	nimodipine 66085-59-4 Nimotop Periplum Nimodipino More...
Iupac Name:	3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
InChI:	InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,19,22H,9-10H2,1-5H3
InChIKey:	UIAGMCDKSXEBJQ-UHFFFAOYSA-N
Canonical Smiles:	CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC
Isomeric Smiles:	CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC
Molecular Weight:	418.4
Molecular Formula:	C21H26N2O7

Compound Structure

2D Structure:

3D Structure:

Computed Properties

nimodipine

Molecular Weight:	418.4
Molecular Formula:	C21H26N2O7
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	8
Rotatable Bond Count:	9
Heavy Atom Count:	30
Complexity:	736

Synonyms

nimodipine

nimodipine	nimodipine
nimodipine	66085-59-4
Nimotop	Periplum
Nimodipino	Admon
Nimodipinum	Bay-E 9736
Nimodipinum INN-Latin	Nimodipino INN-Spanish
BAY e 9736	Bay-e-9736
3-isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate	Isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylate
CHEBI:7575	Nimodipine (Nimotop)
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-methoxyethyl 1-methylethyl ester	C21H26N2O7
MLS000863294	3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Nymalize	MFCD00153848
3-(2-methoxyethyl) 5-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate	NCGC00015714-09
SMR000058300	DSSTox_CID_3370
DSSTox_RID_76998	isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate
DSSTox_GSID_23370	2-methoxyethyl propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
NimoGel	DRG-0139
Nimotop(TM)	1-methylethyl 2-(methyloxy)ethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-beta-methoxyethyl ester 5-isopropyl ester	SR-01000075335
NIMOTOP (TN)	EINECS 266-127-0
BRN 0459792	NimoVent
Nimodipime,(S)	Nimodipine USAN:USP:INN:BAN
Nymalize (TN)	CAS-66085-59-4
EG-1961	Opera_ID_14
Spectrum_001880	SpecPlus_000716
Nimodipine (USP/INN)	Prestwick0_000918
Prestwick1_000918	Prestwick2_000918
Prestwick3_000918	Spectrum2_001562
Spectrum3_000766	Spectrum4_000791
Spectrum5_001687	N-149
CBiol_001832	Lopac0_000891
SCHEMBL34041	BSPBio_000796
BSPBio_001397	BSPBio_002412
KBioGR_000117	KBioGR_001262
KBioSS_000117	KBioSS_002408
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-,2-methoxyethyl 1-methylethyl ester	MLS000069381
MLS001076550	MLS001424155
MLS002154061	MLS002172461
MLS003899190	DivK1c_006812
SPECTRUM1503600	SPBio_001464
SPBio_002985	BPBio1_000876
GTPL2523	CHEMBL3197349
DTXSID5023370	SCHEMBL22882841
KBio1_001756	KBio2_000117
KBio2_002403	KBio2_002685
KBio2_004971	KBio2_005253
KBio2_007539	KBio3_000233
KBio3_000234	KBio3_001632
3-isopropyl 5-(2-methoxyethyl)	BRD8407
Bio1_000118	Bio1_000607
Bio1_001096	Bio2_000117
Bio2_000597	HMS1361F19
HMS1570H18	HMS1791F19
HMS1922E04	HMS1989F19
HMS2052M05	HMS2089H13
HMS2093G11	HMS2097H18
HMS2234B05	HMS3262D04
HMS3266O22	HMS3369G07
HMS3394M05	HMS3402F19
HMS3411I12	HMS3657I03
HMS3675I12	HMS3714H18
Pharmakon1600-01503600	3,5-pyridinecarboxylic acid 2-methoxyethyl 1-methylethyl ester
ACT02628	ALBB-015317
AMY40399	BCP21152
BRD-8407	HY-B0265
2,6-dimethyl-4-(3-nitrophenyl)-	Nimotop\|\|\|Admon\|\|\|BAY-e 9736
Tox21_110202	Tox21_500891
BBL028286	BDBM50101971
CA-211	CCG-39340
NSC758476	s1747
STK642934	AKOS005174934
AKOS015852459	Nimodipine - CAS 66085-59-4
Tox21_110202_1	AC-8484
CCG-101085	DB00393
KS-1304	LP00891
MCULE-4717687158	NC00335
NSC 758476	NSC-758476
SDCCGSBI-0050866.P004	IDI1_033867
isopropyl 2-methoxyethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate	NCGC00015714-04
NCGC00015714-05	NCGC00015714-06
NCGC00015714-07	NCGC00015714-08
NCGC00015714-10	NCGC00015714-11
NCGC00015714-12	NCGC00015714-13
NCGC00015714-16	NCGC00015714-28
NCGC00021456-02	NCGC00024675-02
NCGC00024675-03	NCGC00024675-04
NCGC00024675-05	NCGC00024675-06
NCGC00024675-07	NCGC00024675-08
NCGC00024675-09	NCGC00261576-01
1,4-Dihydro-2,6-dimethyl-4-(3′-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-methoxyethyl-1-methylethyl Ester	1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-methoxyethyl 1-methylethyl ester
Nimodipine 100 microg/mL in Acetonitrile	O5-isopropyl O3-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
SMR002530605	ST082783
SBI-0050866.P003	AB0012346
AB00513963	EU-0100891
FT-0602600	N0896
SW219238-1	C07267
D00438	F20554
1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-	AB00053314-03
AB00053314-04	AB00053314_05
AB00053314_06	085N594
Q421429	SR-01000075335-1
SR-01000075335-2	SR-01000075335-4
SR-01000075335-5	SR-01000075335-7
BRD-A58048407-001-06-3	BRD-A58048407-001-09-7
BAY E 9736 pound>> BAY-E-9736 pound>> BAYE97	Nimodipine, British Pharmacopoeia (BP) Reference Standard
Nimodipine, European Pharmacopoeia (EP) Reference Standard	Nimodipine, United States Pharmacopeia (USP) Reference Standard
Nimodipine, Pharmaceutical Secondary Standard; Certified Reference Material	Nimodipine for peak identification, EuropePharmacopoeia (EP) Reference Standard
1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-methyloxyethyl 1-methylethyl ester	2-Methoxyethyl 1-Methylethyl 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate
3-Isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate #	isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate
methylethyl 5-(2-methoxyethyl)oxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4 -dihydropyridine-3-carboxylate	O5-(2-methoxyethyl) O3-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Experimental Data

nimodipine

Species	Dose	Unit	Control(Avg days)	Treatment(Avg days)	Avg/Med Lifespan Change(%)	Control(Max days)	Treatment(Max days)	Max Lifespan Change(%)	Significant	Strain	Gender	PubMed	Avg/Med Lifespan Change tab
Caenorhabditis elegans	33.000000000000000	umol/L			7.000000000000000				NS	N2		24134630	Inactive

Experimental Data Visualization

nimodipine

Statistics Data

nimodipine

Species	Avg/Med Lifespan Change(%)	Max Lifespan Change(%)	Count Reference	Count Data point
Caenorhabditis elegans	7.000000000000000		1	1

Statistics Data Visualization

nimodipine

Compound Name:

nimodipine

Compound CID:

4497

Synonyms:

nimodipine 66085-59-4 Nimotop Periplum Nimodipino More...

Iupac Name:

3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

InChI:

InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,19,22H,9-10H2,1-5H3

InChIKey:

UIAGMCDKSXEBJQ-UHFFFAOYSA-N

Canonical Smiles:

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC

Isomeric Smiles:

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC

Molecular Weight:

418.4

Molecular Formula:

C21H26N2O7

Molecular Weight:

418.4

Molecular Formula:

C21H26N2O7

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

8

Rotatable Bond Count:

9

Heavy Atom Count:

30

Complexity:

736

nimodipine

66085-59-4

Nimotop

Periplum

Nimodipino

Admon

Nimodipinum

Bay-E 9736

Nimodipinum INN-Latin

Nimodipino INN-Spanish

BAY e 9736

Bay-e-9736

3-isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylate

CHEBI:7575

Nimodipine (Nimotop)

3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-methoxyethyl 1-methylethyl ester

C21H26N2O7

MLS000863294

3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Nymalize

MFCD00153848

3-(2-methoxyethyl) 5-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

NCGC00015714-09

SMR000058300

DSSTox_CID_3370

DSSTox_RID_76998

isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate

DSSTox_GSID_23370

2-methoxyethyl propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

NimoGel

DRG-0139

Nimotop(TM)

1-methylethyl 2-(methyloxy)ethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-beta-methoxyethyl ester 5-isopropyl ester

SR-01000075335

NIMOTOP (TN)

EINECS 266-127-0

BRN 0459792

NimoVent

Nimodipime,(S)

Nimodipine USAN:USP:INN:BAN

Nymalize (TN)

CAS-66085-59-4

EG-1961

Opera_ID_14

nimodipine

66085-59-4

Nimotop

Periplum

Nimodipino

More...