5-ethanoyl-2-sulfanyl-benzenesulfinic acid

Systemtic Name: 5-ethanoyl-2-sulfanyl-benzenesulfinic acid Openeye Name: 5-acetyl-2-sulfanyl-benzenesulfinic acid CAS Name: 5-acetyl-2-mercaptobenzenesulfinic acid IUPAC Name: 5-acetyl-2-sulfanylbenzenesulfinic acid Traditional Name: 5-acetyl-2-mercapto-benzenesulfinic acid Formula: C8H8O3S2 MolecularWeight: 216.27732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8O3S2/c1-5(9)6-2-3-7(12)8(4-6)13(10)11/h2-4,12H,1H3,(H,10,11)