(phenylmethyl) 6-(4-chlorophenyl)-4-oxidanylidene-2-propan-2-yl-1H-pyridine-3-carboxylate

Systemtic Name: (phenylmethyl) 6-(4-chlorophenyl)-4-oxidanylidene-2-propan-2-yl-1H-pyridine-3-carboxylate Openeye Name: benzyl 6-(4-chlorophenyl)-2-isopropyl-4-oxo-1H-pyridine-3-carboxylate CAS Name: 6-(4-chlorophenyl)-4-oxo-2-propan-2-yl-1H-pyridine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(4-chlorophenyl)-4-oxo-2-propan-2-yl-1H-pyridine-3-carboxylate Traditional Name: 6-(4-chlorophenyl)-2-isopropyl-4-keto-1H-pyridine-3-carboxylic acid benzyl ester Formula: C22H20ClNO3 MolecularWeight: 381.8521

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)C=C(N1)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C(=O)C=C(N1)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20ClNO3/c1-14(2)21-20(22(26)27-13-15-6-4-3-5-7-15)19(25)12-18(24-21)16-8-10-17(23)11-9-16/h3-12,14H,13H2,1-2H3,(H,24,25)