5-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-2-phenyl-pentanenitrile

Systemtic Name: 5-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-2-phenyl-pentanenitrile Openeye Name: 5-chloro-4-oxo-2-phenyl-2-(p-tolyl)pentanenitrile CAS Name: 5-chloro-2-(4-methylphenyl)-4-oxo-2-phenylpentanenitrile IUPAC Name: 5-chloro-2-(4-methylphenyl)-4-oxo-2-phenylpentanenitrile Traditional Name: 5-chloro-4-keto-2-phenyl-2-(p-tolyl)valeronitrile Formula: C18H16ClNO MolecularWeight: 297.77874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)CCl)(C#N)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)CCl)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C18H16ClNO/c1-14-7-9-16(10-8-14)18(13-20,11-17(21)12-19)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3