(4-methylphenyl) 1,3-bis(oxidanylidene)-2-(4-phenacyloxycarbonylphenyl)isoindole-5-carboxylate

Systemtic Name: (4-methylphenyl) 1,3-bis(oxidanylidene)-2-(4-phenacyloxycarbonylphenyl)isoindole-5-carboxylate Openeye Name: p-tolyl 1,3-dioxo-2-(4-phenacyloxycarbonylphenyl)isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-[4-[oxo(phenacyloxy)methyl]phenyl]-5-isoindolecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 1,3-dioxo-2-(4-phenacyloxycarbonylphenyl)isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-phenacyloxycarbonylphenyl)isoindoline-5-carboxylic acid p-tolyl ester Formula: C31H21NO7 MolecularWeight: 519.50094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H21NO7/c1-19-7-14-24(15-8-19)39-31(37)22-11-16-25-26(17-22)29(35)32(28(25)34)23-12-9-21(10-13-23)30(36)38-18-27(33)20-5-3-2-4-6-20/h2-17H,18H2,1H3