4-(5-oxidanyl-7-oxidanylidene-7-phenyl-heptyl)benzenecarbonitrile

Systemtic Name: 4-(5-oxidanyl-7-oxidanylidene-7-phenyl-heptyl)benzenecarbonitrile Openeye Name: 4-(5-hydroxy-7-oxo-7-phenyl-heptyl)benzonitrile CAS Name: 4-(5-hydroxy-7-oxo-7-phenylheptyl)benzonitrile IUPAC Name: 4-(5-hydroxy-7-oxo-7-phenylheptyl)benzonitrile Traditional Name: 4-(5-hydroxy-7-keto-7-phenyl-heptyl)benzonitrile Formula: C20H21NO2 MolecularWeight: 307.38624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(CCCCC2=CC=C(C=C2)C#N)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(CCCCC2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C20H21NO2/c21-15-17-12-10-16(11-13-17)6-4-5-9-19(22)14-20(23)18-7-2-1-3-8-18/h1-3,7-8,10-13,19,22H,4-6,9,14H2