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

Systemtic Name: bis(3-pyridin-4-ylpropyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis[3-(4-pyridyl)propyl] 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 bis(3-pyridin-4-ylpropyl) ester IUPAC Name: bis(3-pyridin-4-ylpropyl) 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 bis[3-(4-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=NC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCCC4=CC=NC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCCC2=CC=NC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCCC4=CC=NC=C4

InChI

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