[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 2-(4-bromanyl-2-methyl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 2-(4-bromanyl-2-methyl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 2-(4-bromo-2-methyl-phenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-bromo-2-methylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 2-(4-bromo-2-methylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-bromo-2-methyl-phenyl)-1,3-diketo-isoindoline-5-carboxylic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C31H22BrNO6 MolecularWeight: 584.41348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)Br)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C31H22BrNO6/c1-19-15-23(32)10-14-27(19)33-29(35)25-13-9-22(16-26(25)30(33)36)31(37)39-18-28(34)21-7-11-24(12-8-21)38-17-20-5-3-2-4-6-20/h2-16H,17-18H2,1H3