5-oxidanylidene-4-phenyl-hexanenitrile

Systemtic Name: 5-oxidanylidene-4-phenyl-hexanenitrile Openeye Name: 5-oxo-4-phenyl-hexanenitrile CAS Name: 5-oxo-4-phenylhexanenitrile IUPAC Name: 5-oxo-4-phenylhexanenitrile Traditional Name: 5-keto-4-phenyl-hexanenitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO/c1-10(14)12(8-5-9-13)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8H2,1H3