3-(4-chlorophenyl)-5-oxidanylidene-2-phenyl-hexanenitrile

Systemtic Name: 3-(4-chlorophenyl)-5-oxidanylidene-2-phenyl-hexanenitrile Openeye Name: 3-(4-chlorophenyl)-5-oxo-2-phenyl-hexanenitrile CAS Name: 3-(4-chlorophenyl)-5-oxo-2-phenylhexanenitrile IUPAC Name: 3-(4-chlorophenyl)-5-oxo-2-phenylhexanenitrile Traditional Name: 3-(4-chlorophenyl)-5-keto-2-phenyl-hexanenitrile Formula: C18H16ClNO MolecularWeight: 297.77874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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