methyl 5-cyano-2-ethyl-4-(4-nitrophenyl)-6-phenyl-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-2-ethyl-4-(4-nitrophenyl)-6-phenyl-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-2-ethyl-4-(4-nitrophenyl)-6-phenyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-ethyl-4-(4-nitrophenyl)-6-phenyl-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-2-ethyl-4-(4-nitrophenyl)-6-phenylpyridine-3-carboxylate Traditional Name: 5-cyano-2-ethyl-4-(4-nitrophenyl)-6-phenyl-nicotinic acid methyl ester Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=N1)C2=CC=CC=C2)C#N)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(C(=N1)C2=CC=CC=C2)C#N)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C22H17N3O4/c1-3-18-20(22(26)29-2)19(14-9-11-16(12-10-14)25(27)28)17(13-23)21(24-18)15-7-5-4-6-8-15/h4-12H,3H2,1-2H3