2-[3-(phenylcarbonyl)phenyl]propanenitrile

Systemtic Name: 2-[3-(phenylcarbonyl)phenyl]propanenitrile Openeye Name: 2-(3-benzoylphenyl)propanenitrile CAS Name: 2-(3-benzoylphenyl)propanenitrile IUPAC Name: 2-(3-benzoylphenyl)propanenitrile Traditional Name: 2-(3-benzoylphenyl)propionitrile Formula: C16H13NO MolecularWeight: 236.273175

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC=CC(=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC([13C]#N)C1=CC=CC(=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H13NO/c1-12(11-17)14-8-5-9-15(10-14)16(18)13-6-3-2-4-7-13/h2-10,12H,1H3/i11+1