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

Systemtic Name: 2-(4-methylphenyl)-3-oxidanylidene-butanenitrile Openeye Name: 3-oxo-2-(p-tolyl)butanenitrile CAS Name: 2-(4-methylphenyl)-3-oxobutanenitrile IUPAC Name: 2-(4-methylphenyl)-3-oxobutanenitrile Traditional Name: 3-keto-2-(p-tolyl)butyronitrile Formula: C11H11NO MolecularWeight: 173.21114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO/c1-8-3-5-10(6-4-8)11(7-12)9(2)13/h3-6,11H,1-2H3