2-(3-oxidanylpropylsulfanyl)-5-sulfamoyl-benzoic acid

Systemtic Name: 2-(3-oxidanylpropylsulfanyl)-5-sulfamoyl-benzoic acid Openeye Name: 2-(3-hydroxypropylsulfanyl)-5-sulfamoyl-benzoic acid CAS Name: 2-(3-hydroxypropylthio)-5-sulfamoylbenzoic acid IUPAC Name: 2-(3-hydroxypropylsulfanyl)-5-sulfamoylbenzoic acid Traditional Name: 2-(3-hydroxypropylthio)-5-sulfamoyl-benzoic acid Formula: C10H13NO5S2 MolecularWeight: 291.34392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N)C(=O)O)SCCCO

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N)C(=O)O)SCCCO

InChI

InChI=1S/C10H13NO5S2/c11-18(15,16)7-2-3-9(17-5-1-4-12)8(6-7)10(13)14/h2-3,6,12H,1,4-5H2,(H,13,14)(H2,11,15,16)