methyl 5-cyano-6-oxidanylidene-4-phenyl-2-(phenylazanylmethyl)-1H-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-6-oxidanylidene-4-phenyl-2-(phenylazanylmethyl)-1H-pyridine-3-carboxylate Openeye Name: methyl 2-(anilinomethyl)-5-cyano-6-oxo-4-phenyl-1H-pyridine-3-carboxylate CAS Name: 2-(anilinomethyl)-5-cyano-6-oxo-4-phenyl-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(anilinomethyl)-5-cyano-6-oxo-4-phenyl-1H-pyridine-3-carboxylate Traditional Name: 2-(anilinomethyl)-5-cyano-6-keto-4-phenyl-1H-pyridine-3-carboxylic acid methyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=O)C(=C1C2=CC=CC=C2)C#N)CNC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(NC(=O)C(=C1C2=CC=CC=C2)C#N)CNC3=CC=CC=C3

InChI

InChI=1S/C21H17N3O3/c1-27-21(26)19-17(13-23-15-10-6-3-7-11-15)24-20(25)16(12-22)18(19)14-8-4-2-5-9-14/h2-11,23H,13H2,1H3,(H,24,25)