2-(3-butylphenyl)-3-oxidanylidene-4-phenyl-butanenitrile

Systemtic Name: 2-(3-butylphenyl)-3-oxidanylidene-4-phenyl-butanenitrile Openeye Name: 2-(3-butylphenyl)-3-oxo-4-phenyl-butanenitrile CAS Name: 2-(3-butylphenyl)-3-oxo-4-phenylbutanenitrile IUPAC Name: 2-(3-butylphenyl)-3-oxo-4-phenylbutanenitrile Traditional Name: 2-(3-butylphenyl)-3-keto-4-phenyl-butyronitrile Formula: C20H21NO MolecularWeight: 291.38684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)C(C#N)C(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC(=CC=C1)C(C#N)C(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H21NO/c1-2-3-8-16-11-7-12-18(13-16)19(15-21)20(22)14-17-9-5-4-6-10-17/h4-7,9-13,19H,2-3,8,14H2,1H3