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

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

InChI

InChI=1S/C31H32N4O6/c1-21-27(30(36)40-19-3-5-23-11-15-32-16-12-23)29(25-7-9-26(10-8-25)35(38)39)28(22(2)34-21)31(37)41-20-4-6-24-13-17-33-18-14-24/h7-18,29,34H,3-6,19-20H2,1-2H3