4-(5-methoxy-3,3-diphenyl-isoindol-1-yl)carbonylbenzenecarbonitrile

Systemtic Name: 4-(5-methoxy-3,3-diphenyl-isoindol-1-yl)carbonylbenzenecarbonitrile Openeye Name: 4-(5-methoxy-3,3-diphenyl-isoindole-1-carbonyl)benzonitrile CAS Name: 4-[(5-methoxy-3,3-diphenyl-1-isoindolyl)-oxomethyl]benzonitrile IUPAC Name: 4-(5-methoxy-3,3-diphenylisoindole-1-carbonyl)benzonitrile Traditional Name: 4-(5-methoxy-3,3-diphenyl-isoindole-1-carbonyl)benzonitrile Formula: C29H20N2O2 MolecularWeight: 428.4813

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC2(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC2(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H20N2O2/c1-33-24-16-17-25-26(18-24)29(22-8-4-2-5-9-22,23-10-6-3-7-11-23)31-27(25)28(32)21-14-12-20(19-30)13-15-21/h2-18H,1H3