2-[2-(4-methylphenyl)carbonylphenyl]ethanenitrile

Systemtic Name: 2-[2-(4-methylphenyl)carbonylphenyl]ethanenitrile Openeye Name: 2-[2-(4-methylbenzoyl)phenyl]acetonitrile CAS Name: 2-[2-[(4-methylphenyl)-oxomethyl]phenyl]acetonitrile IUPAC Name: 2-[2-(4-methylbenzoyl)phenyl]acetonitrile Traditional Name: 2-(2-p-toluoylphenyl)acetonitrile Formula: C16H13NO MolecularWeight: 235.28052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2CC#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2CC#N

InChI

InChI=1S/C16H13NO/c1-12-6-8-14(9-7-12)16(18)15-5-3-2-4-13(15)10-11-17/h2-9H,10H2,1H3