2-(4-methylphenyl)carbonyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(4-methylphenyl)carbonyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(4-methylbenzoyl)-3-oxo-butanenitrile CAS Name: 2-[(4-methylphenyl)-oxomethyl]-3-oxobutanenitrile IUPAC Name: 2-(4-methylbenzoyl)-3-oxobutanenitrile Traditional Name: 3-keto-2-p-toluoyl-butyronitrile Formula: C12H11NO2 MolecularWeight: 201.22124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO2/c1-8-3-5-10(6-4-8)12(15)11(7-13)9(2)14/h3-6,11H,1-2H3