1-(4-cyanophenyl)carbonyl-3,3-diphenyl-isoindole-5-carbonitrile

Systemtic Name: 1-(4-cyanophenyl)carbonyl-3,3-diphenyl-isoindole-5-carbonitrile Openeye Name: 1-(4-cyanobenzoyl)-3,3-diphenyl-isoindole-5-carbonitrile CAS Name: 1-[(4-cyanophenyl)-oxomethyl]-3,3-diphenyl-5-isoindolecarbonitrile IUPAC Name: 1-(4-cyanobenzoyl)-3,3-diphenylisoindole-5-carbonitrile Traditional Name: 1-(4-cyanobenzoyl)-3,3-diphenyl-isoindole-5-carbonitrile Formula: C29H17N3O MolecularWeight: 423.46478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C3=C(C=CC(=C3)C#N)C(=N2)C(=O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2(C3=C(C=CC(=C3)C#N)C(=N2)C(=O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C29H17N3O/c30-18-20-11-14-22(15-12-20)28(33)27-25-16-13-21(19-31)17-26(25)29(32-27,23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-17H