cyanomethyl 2-(4-methylphenyl)carbonylbenzoate

Systemtic Name: cyanomethyl 2-(4-methylphenyl)carbonylbenzoate Openeye Name: cyanomethyl 2-(4-methylbenzoyl)benzoate CAS Name: 2-[(4-methylphenyl)-oxomethyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(4-methylbenzoyl)benzoate Traditional Name: 2-p-toluoylbenzoic acid cyanomethyl ester Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC#N

InChI

InChI=1S/C17H13NO3/c1-12-6-8-13(9-7-12)16(19)14-4-2-3-5-15(14)17(20)21-11-10-18/h2-9H,11H2,1H3