2-(4-methoxy-2-methyl-phenyl)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(4-methoxy-2-methyl-phenyl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(4-methoxy-2-methyl-phenyl)-3-oxo-butanenitrile CAS Name: 2-(4-methoxy-2-methylphenyl)-3-oxobutanenitrile IUPAC Name: 2-(4-methoxy-2-methylphenyl)-3-oxobutanenitrile Traditional Name: 3-keto-2-(4-methoxy-2-methyl-phenyl)butyronitrile Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO2/c1-8-6-10(15-3)4-5-11(8)12(7-13)9(2)14/h4-6,12H,1-3H3