O3-methyl O5-(1-phenyl-2-pyrrolidin-1-yl-ethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-(1-phenyl-2-pyrrolidin-1-yl-ethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-(1-phenyl-2-pyrrolidin-1-yl-ethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-[1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: 3-O-methyl 5-O-(1-phenyl-2-pyrrolidin-1-ylethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-(1-phenyl-2-pyrrolidino-ethyl) ester Formula: C28H31N3O6 MolecularWeight: 505.56224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(CN2CCCC2)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(CN2CCCC2)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C28H31N3O6/c1-18-24(27(32)36-3)26(21-12-9-13-22(16-21)31(34)35)25(19(2)29-18)28(33)37-23(17-30-14-7-8-15-30)20-10-5-4-6-11-20/h4-6,9-13,16,23,26,29H,7-8,14-15,17H2,1-3H3