4-(4-chlorophenyl)-4-oxidanylidene-2-(phenylcarbonyl)butanenitrile

Systemtic Name: 4-(4-chlorophenyl)-4-oxidanylidene-2-(phenylcarbonyl)butanenitrile Openeye Name: 2-benzoyl-4-(4-chlorophenyl)-4-oxo-butanenitrile CAS Name: 2-benzoyl-4-(4-chlorophenyl)-4-oxobutanenitrile IUPAC Name: 2-benzoyl-4-(4-chlorophenyl)-4-oxobutanenitrile Traditional Name: 2-benzoyl-4-(4-chlorophenyl)-4-keto-butyronitrile Formula: C17H12ClNO2 MolecularWeight: 297.73568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClNO2/c18-15-8-6-12(7-9-15)16(20)10-14(11-19)17(21)13-4-2-1-3-5-13/h1-9,14H,10H2