5,5-dimethyl-2-(2-methylphenyl)-3-oxidanylidene-hexanenitrile

Systemtic Name: 5,5-dimethyl-2-(2-methylphenyl)-3-oxidanylidene-hexanenitrile Openeye Name: 5,5-dimethyl-2-(o-tolyl)-3-oxo-hexanenitrile CAS Name: 5,5-dimethyl-2-(2-methylphenyl)-3-oxohexanenitrile IUPAC Name: 5,5-dimethyl-2-(2-methylphenyl)-3-oxohexanenitrile Traditional Name: 3-keto-5,5-dimethyl-2-(o-tolyl)hexanenitrile Formula: C15H19NO MolecularWeight: 229.31746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO/c1-11-7-5-6-8-12(11)13(10-16)14(17)9-15(2,3)4/h5-8,13H,9H2,1-4H3