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

Systemtic Name: 1-(4-methylphenyl)carbonyl-3,3-diphenyl-isoindole-5-carbonitrile Openeye Name: 1-(4-methylbenzoyl)-3,3-diphenyl-isoindole-5-carbonitrile CAS Name: 1-[(4-methylphenyl)-oxomethyl]-3,3-diphenyl-5-isoindolecarbonitrile IUPAC Name: 1-(4-methylbenzoyl)-3,3-diphenylisoindole-5-carbonitrile Traditional Name: 3,3-diphenyl-1-p-toluoyl-isoindole-5-carbonitrile Formula: C29H20N2O MolecularWeight: 412.4819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=NC(C3=C2C=CC(=C3)C#N)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=NC(C3=C2C=CC(=C3)C#N)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H20N2O/c1-20-12-15-22(16-13-20)28(32)27-25-17-14-21(19-30)18-26(25)29(31-27,23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-18H,1H3