2-(2,4-dimethylphenyl)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(2,4-dimethylphenyl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(2,4-dimethylphenyl)-3-oxo-butanenitrile CAS Name: 2-(2,4-dimethylphenyl)-3-oxobutanenitrile IUPAC Name: 2-(2,4-dimethylphenyl)-3-oxobutanenitrile Traditional Name: 2-(2,4-dimethylphenyl)-3-keto-butyronitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO/c1-8-4-5-11(9(2)6-8)12(7-13)10(3)14/h4-6,12H,1-3H3