2-(3-chlorophenyl)-3-oxidanylidene-6-phenyl-hexanenitrile

Systemtic Name: 2-(3-chlorophenyl)-3-oxidanylidene-6-phenyl-hexanenitrile Openeye Name: 2-(3-chlorophenyl)-3-oxo-6-phenyl-hexanenitrile CAS Name: 2-(3-chlorophenyl)-3-oxo-6-phenylhexanenitrile IUPAC Name: 2-(3-chlorophenyl)-3-oxo-6-phenylhexanenitrile Traditional Name: 2-(3-chlorophenyl)-3-keto-6-phenyl-hexanenitrile Formula: C18H16ClNO MolecularWeight: 297.77874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClNO/c19-16-10-5-9-15(12-16)17(13-20)18(21)11-4-8-14-6-2-1-3-7-14/h1-3,5-7,9-10,12,17H,4,8,11H2