[2-(4-methylphenyl)-2-oxidanylidene-1-phenyl-ethyl] pyridine-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-1-phenyl-ethyl] pyridine-4-carboxylate Openeye Name: [2-oxo-1-phenyl-2-(p-tolyl)ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-(4-methylphenyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxo-1-phenylethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-keto-1-phenyl-2-(p-tolyl)ethyl] ester Formula: C21H17NO3 MolecularWeight: 331.36458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H17NO3/c1-15-7-9-16(10-8-15)19(23)20(17-5-3-2-4-6-17)25-21(24)18-11-13-22-14-12-18/h2-14,20H,1H3