2-(4-bromanyl-6,6-diphenyl-cyclohexa-2,4-dien-1-yl)ethanenitrile

Systemtic Name: 2-(4-bromanyl-6,6-diphenyl-cyclohexa-2,4-dien-1-yl)ethanenitrile Openeye Name: 2-(4-bromo-6,6-diphenyl-cyclohexa-2,4-dien-1-yl)acetonitrile CAS Name: 2-(4-bromo-6,6-diphenyl-1-cyclohexa-2,4-dienyl)acetonitrile IUPAC Name: 2-(4-bromo-6,6-diphenylcyclohexa-2,4-dien-1-yl)acetonitrile Traditional Name: 2-(4-bromo-6,6-diphenyl-cyclohexa-2,4-dien-1-yl)acetonitrile Formula: C20H16BrN MolecularWeight: 350.25174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C=C(C=CC2CC#N)Br)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2(C=C(C=CC2CC#N)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H16BrN/c21-19-12-11-18(13-14-22)20(15-19,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,18H,13H2