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

Systemtic Name: bis[2-(pyridin-3-ylcarbonylamino)ethyl] 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis[2-(pyridine-3-carbonylamino)ethyl] 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(2-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-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(2-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)44-15-13-34-28(38)21-7-5-11-32-17-21)27(23-9-3-4-10-24(23)37(42)43)26(20(2)36-19)31(41)45-16-14-35-29(39)22-8-6-12-33-18-22/h3-12,17-18,27,36H,13-16H2,1-2H3,(H,34,38)(H,35,39)