5-(4-chloranyl-1-phenyl-butyl)-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 5-(4-chloranyl-1-phenyl-butyl)-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 5-(4-chloro-1-phenyl-butyl)-6-oxo-cyclohexa-1,3-diene-1-carbonitrile CAS Name: 5-(4-chloro-1-phenylbutyl)-6-oxo-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 5-(4-chloro-1-phenylbutyl)-6-oxocyclohexa-1,3-diene-1-carbonitrile Traditional Name: 5-(4-chloro-1-phenyl-butyl)-6-keto-cyclohexa-1,3-diene-1-carbonitrile Formula: C17H16ClNO MolecularWeight: 285.76804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCCl)C2C=CC=C(C2=O)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCCCl)C2C=CC=C(C2=O)C#N

InChI

InChI=1S/C17H16ClNO/c18-11-5-10-15(13-6-2-1-3-7-13)16-9-4-8-14(12-19)17(16)20/h1-4,6-9,15-16H,5,10-11H2