O5-hexyl O3-[[1-(phenylmethyl)pyrrolidin-2-yl]methyl] 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-hexyl O3-[[1-(phenylmethyl)pyrrolidin-2-yl]methyl] 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-[(1-benzylpyrrolidin-2-yl)methyl] O5-hexyl 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-hexyl ester O3-[[1-(phenylmethyl)-2-pyrrolidinyl]methyl] ester IUPAC Name: 3-O-[(1-benzylpyrrolidin-2-yl)methyl] 5-O-hexyl 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-[(1-benzylpyrrolidin-2-yl)methyl] ester O5-hexyl ester Formula: C32H40N4O6 MolecularWeight: 576.6832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC3CCCN3CC4=CC=CC=C4)N)C

Isomeric SMILES

CCCCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC3CCCN3CC4=CC=CC=C4)N)C

InChI

InChI=1S/C32H40N4O6/c1-3-4-5-9-18-41-31(37)27-22(2)34-30(33)29(28(27)24-14-10-15-25(19-24)36(39)40)32(38)42-21-26-16-11-17-35(26)20-23-12-7-6-8-13-23/h6-8,10,12-15,19,26,28,34H,3-5,9,11,16-18,20-21,33H2,1-2H3