5-ethanoyl-2-sulfanyl-benzenesulfonic acid

Systemtic Name: 5-ethanoyl-2-sulfanyl-benzenesulfonic acid Openeye Name: 5-acetyl-2-sulfanyl-benzenesulfonic acid CAS Name: 5-acetyl-2-mercaptobenzenesulfonic acid IUPAC Name: 5-acetyl-2-sulfanylbenzenesulfonic acid Traditional Name: 5-acetyl-2-mercapto-besylic acid Formula: C8H8O4S2 MolecularWeight: 232.27672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)S)S(=O)(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)S)S(=O)(=O)O

InChI

InChI=1S/C8H8O4S2/c1-5(9)6-2-3-7(13)8(4-6)14(10,11)12/h2-4,13H,1H3,(H,10,11,12)