5,5-dimethyl-3-oxidanylidene-2-phenyl-hexanenitrile

Systemtic Name: 5,5-dimethyl-3-oxidanylidene-2-phenyl-hexanenitrile Openeye Name: 5,5-dimethyl-3-oxo-2-phenyl-hexanenitrile CAS Name: 5,5-dimethyl-3-oxo-2-phenylhexanenitrile IUPAC Name: 5,5-dimethyl-3-oxo-2-phenylhexanenitrile Traditional Name: 3-keto-5,5-dimethyl-2-phenyl-hexanenitrile Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO/c1-14(2,3)9-13(16)12(10-15)11-7-5-4-6-8-11/h4-8,12H,9H2,1-3H3