dimethyl 1-[2-(4-chlorophenyl)ethyl]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[2-(4-chlorophenyl)ethyl]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-[2-(4-chlorophenyl)ethyl]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-[2-(4-chlorophenyl)ethyl]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[2-(4-chlorophenyl)ethyl]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-[2-(4-chlorophenyl)ethyl]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C23H21ClN2O6 MolecularWeight: 456.87564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)CCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)CCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H21ClN2O6/c1-31-22(27)19-13-25(11-10-15-6-8-17(24)9-7-15)14-20(23(28)32-2)21(19)16-4-3-5-18(12-16)26(29)30/h3-9,12-14,21H,10-11H2,1-2H3