bis(3-pyridin-2-ylpropyl) 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis(3-pyridin-2-ylpropyl) 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis[3-(2-pyridyl)propyl] 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis[3-(2-pyridinyl)propyl] ester IUPAC Name: bis(3-pyridin-2-ylpropyl) 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis[3-(2-pyridyl)propyl] ester Formula: C31H32N4O6 MolecularWeight: 556.60898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCCC2=CC=CC=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCCC4=CC=CC=N4

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCCC2=CC=CC=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCCC4=CC=CC=N4

InChI

InChI=1S/C31H32N4O6/c1-21-27(30(36)40-19-7-11-24-9-3-5-17-32-24)29(23-13-15-26(16-14-23)35(38)39)28(22(2)34-21)31(37)41-20-8-12-25-10-4-6-18-33-25/h3-6,9-10,13-18,29,34H,7-8,11-12,19-20H2,1-2H3