bis[(4-bromophenyl)methyl] 5,5-bis(oxidanylidene)dibenzothiophene-3,7-dicarboxylate

Systemtic Name: bis[(4-bromophenyl)methyl] 5,5-bis(oxidanylidene)dibenzothiophene-3,7-dicarboxylate Openeye Name: bis[(4-bromophenyl)methyl] 5,5-dioxodibenzothiophene-3,7-dicarboxylate CAS Name: 5,5-dioxodibenzothiophene-3,7-dicarboxylic acid bis[(4-bromophenyl)methyl] ester IUPAC Name: bis[(4-bromophenyl)methyl] 5,5-dioxodibenzothiophene-3,7-dicarboxylate Traditional Name: 5,5-diketodibenzothiophene-3,7-dicarboxylic acid bis(4-bromobenzyl) ester Formula: C28H18Br2O6S MolecularWeight: 642.31192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=CC3=C(C=C2)C4=C(S3(=O)=O)C=C(C=C4)C(=O)OCC5=CC=C(C=C5)Br)Br

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=CC3=C(C=C2)C4=C(S3(=O)=O)C=C(C=C4)C(=O)OCC5=CC=C(C=C5)Br)Br

InChI

InChI=1S/C28H18Br2O6S/c29-21-7-1-17(2-8-21)15-35-27(31)19-5-11-23-24-12-6-20(14-26(24)37(33,34)25(23)13-19)28(32)36-16-18-3-9-22(30)10-4-18/h1-14H,15-16H2