4-[(E)-2-cyano-3-(2-methylphenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-cyano-3-(2-methylphenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-cyano-3-(o-tolyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-2-cyano-3-(2-methylphenyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-2-cyano-3-(2-methylphenyl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-2-cyano-3-keto-3-(o-tolyl)prop-1-enyl]benzonitrile Formula: C18H12N2O MolecularWeight: 272.30068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(=CC2=CC=C(C=C2)C#N)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)/C(=C/C2=CC=C(C=C2)C#N)/C#N

InChI

InChI=1S/C18H12N2O/c1-13-4-2-3-5-17(13)18(21)16(12-20)10-14-6-8-15(11-19)9-7-14/h2-10H,1H3/b16-10+