bis[2-(pyridin-3-ylcarbonylamino)ethyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis[2-(pyridin-3-ylcarbonylamino)ethyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis[2-(pyridine-3-carbonylamino)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 bis[2-[[oxo(3-pyridinyl)methyl]amino]ethyl] ester IUPAC Name: bis[2-(pyridine-3-carbonylamino)ethyl] 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(2-nicotinamidoethyl) ester Formula: C31H30N6O8 MolecularWeight: 614.6053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCNC(=O)C2=CN=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCNC(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCNC(=O)C2=CN=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCNC(=O)C4=CN=CC=C4

InChI

InChI=1S/C31H30N6O8/c1-19-25(30(40)44-14-12-34-28(38)22-7-4-10-32-17-22)27(21-6-3-9-24(16-21)37(42)43)26(20(2)36-19)31(41)45-15-13-35-29(39)23-8-5-11-33-18-23/h3-11,16-18,27,36H,12-15H2,1-2H3,(H,34,38)(H,35,39)