2-(4-hexylphenyl)-2-phenyl-ethanenitrile

Systemtic Name: 2-(4-hexylphenyl)-2-phenyl-ethanenitrile Openeye Name: 2-(4-hexylphenyl)-2-phenyl-acetonitrile CAS Name: 2-(4-hexylphenyl)-2-phenylacetonitrile IUPAC Name: 2-(4-hexylphenyl)-2-phenylacetonitrile Traditional Name: 2-(4-hexylphenyl)-2-phenyl-acetonitrile Formula: C20H23N MolecularWeight: 277.40332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(C#N)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(C#N)C2=CC=CC=C2

InChI

InChI=1S/C20H23N/c1-2-3-4-6-9-17-12-14-19(15-13-17)20(16-21)18-10-7-5-8-11-18/h5,7-8,10-15,20H,2-4,6,9H2,1H3