[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(4-butoxycarbonylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(4-butoxycarbonylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-(4-butoxycarbonylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[4-[butoxy(oxo)methyl]phenyl]-1,3-dioxo-5-isoindolecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-(4-butoxycarbonylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-butoxycarbonylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C28H22BrNO7 MolecularWeight: 564.38078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H22BrNO7/c1-2-3-14-36-27(34)18-6-11-21(12-7-18)30-25(32)22-13-8-19(15-23(22)26(30)33)28(35)37-16-24(31)17-4-9-20(29)10-5-17/h4-13,15H,2-3,14,16H2,1H3