bis[7-(4-bromophenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] benzene-1,3-dicarboxylate

Systemtic Name: bis[7-(4-bromophenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] benzene-1,3-dicarboxylate Openeye Name: bis[7-(4-bromophenyl)-2-oxo-1,3-benzoxathiol-5-yl] benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis[7-(4-bromophenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: bis[7-(4-bromophenyl)-2-oxo-1,3-benzoxathiol-5-yl] benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis[7-(4-bromophenyl)-2-keto-1,3-benzoxathiol-5-yl] ester Formula: C34H16Br2O8S2 MolecularWeight: 776.42404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC=C(C=C4)Br)OC(=O)S3)C(=O)OC5=CC6=C(C(=C5)C7=CC=C(C=C7)Br)OC(=O)S6

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC=C(C=C4)Br)OC(=O)S3)C(=O)OC5=CC6=C(C(=C5)C7=CC=C(C=C7)Br)OC(=O)S6

InChI

InChI=1S/C34H16Br2O8S2/c35-21-8-4-17(5-9-21)25-13-23(15-27-29(25)43-33(39)45-27)41-31(37)19-2-1-3-20(12-19)32(38)42-24-14-26(18-6-10-22(36)11-7-18)30-28(16-24)46-34(40)44-30/h1-16H