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

Systemtic Name: (4-bromophenyl)methyl 2-(4-methylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (4-bromophenyl)methyl 1,3-dioxo-2-(p-tolyl)isoindoline-5-carboxylate CAS Name: 2-(4-methylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-(4-methylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(p-tolyl)isoindoline-5-carboxylic acid (4-bromobenzyl) ester Formula: C23H16BrNO4 MolecularWeight: 450.28144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H16BrNO4/c1-14-2-9-18(10-3-14)25-21(26)19-11-6-16(12-20(19)22(25)27)23(28)29-13-15-4-7-17(24)8-5-15/h2-12H,13H2,1H3