2-bromanyl-7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid

Systemtic Name: 2-bromanyl-7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid Openeye Name: 2-bromo-7-oxo-5,6-dihydro-4H-benzothiophene-3-sulfonic acid CAS Name: 2-bromo-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid IUPAC Name: 2-bromo-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-sulfonic acid Traditional Name: 2-bromo-7-keto-5,6-dihydro-4H-benzothiophene-3-sulfonic acid Formula: C8H7BrO4S2 MolecularWeight: 311.17278

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)SC(=C2S(=O)(=O)O)Br

Isomeric SMILES

C1CC2=C(C(=O)C1)SC(=C2S(=O)(=O)O)Br

InChI

InChI=1S/C8H7BrO4S2/c9-8-7(15(11,12)13)4-2-1-3-5(10)6(4)14-8/h1-3H2,(H,11,12,13)