[4,6-bis(bromanyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] benzenesulfonate

Systemtic Name: [4,6-bis(bromanyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] benzenesulfonate Openeye Name: (4,6-dibromo-2-oxo-1,3-benzoxathiol-5-yl) benzenesulfonate CAS Name: benzenesulfonic acid (4,6-dibromo-2-oxo-1,3-benzoxathiol-5-yl) ester IUPAC Name: (4,6-dibromo-2-oxo-1,3-benzoxathiol-5-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (4,6-dibromo-2-keto-1,3-benzoxathiol-5-yl) ester Formula: C13H6Br2O5S2 MolecularWeight: 466.12174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C(=C2Br)SC(=O)O3)Br

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C(=C2Br)SC(=O)O3)Br

InChI

InChI=1S/C13H6Br2O5S2/c14-8-6-9-12(21-13(16)19-9)10(15)11(8)20-22(17,18)7-4-2-1-3-5-7/h1-6H