(E)-2-(4-methylphenyl)carbonyl-3-phenyl-prop-2-enenitrile

Systemtic Name: (E)-2-(4-methylphenyl)carbonyl-3-phenyl-prop-2-enenitrile Openeye Name: (E)-2-(4-methylbenzoyl)-3-phenyl-prop-2-enenitrile CAS Name: (E)-2-[(4-methylphenyl)-oxomethyl]-3-phenyl-2-propenenitrile IUPAC Name: (E)-2-(4-methylbenzoyl)-3-phenylprop-2-enenitrile Traditional Name: (E)-3-phenyl-2-p-toluoyl-acrylonitrile Formula: C17H13NO MolecularWeight: 247.29122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=CC2=CC=CC=C2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C17H13NO/c1-13-7-9-15(10-8-13)17(19)16(12-18)11-14-5-3-2-4-6-14/h2-11H,1H3/b16-11+