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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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