2-ethanoyl-5-oxidanylidene-2-phenyl-pentanenitrile

Systemtic Name: 2-ethanoyl-5-oxidanylidene-2-phenyl-pentanenitrile Openeye Name: 2-acetyl-5-oxo-2-phenyl-pentanenitrile CAS Name: 2-acetyl-5-oxo-2-phenylpentanenitrile IUPAC Name: 2-acetyl-5-oxo-2-phenylpentanenitrile Traditional Name: 2-acetyl-5-keto-2-phenyl-valeronitrile Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO2/c1-11(16)13(10-14,8-5-9-15)12-6-3-2-4-7-12/h2-4,6-7,9H,5,8H2,1H3