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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CCC#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)CCC#N

InChI

InChI=1S/C11H11NO/c1-9-5-2-3-6-10(9)11(13)7-4-8-12/h2-3,5-6H,4,7H2,1H3