methyl 2-(2-hydroxyethylsulfanyl)-5-sulfamoyl-benzoate

Systemtic Name: methyl 2-(2-hydroxyethylsulfanyl)-5-sulfamoyl-benzoate Openeye Name: methyl 2-(2-hydroxyethylsulfanyl)-5-sulfamoyl-benzoate CAS Name: 2-(2-hydroxyethylthio)-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 2-(2-hydroxyethylsulfanyl)-5-sulfamoylbenzoate Traditional Name: 2-(2-hydroxyethylthio)-5-sulfamoyl-benzoic acid methyl ester Formula: C10H13NO5S2 MolecularWeight: 291.34392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)SCCO

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)SCCO

InChI

InChI=1S/C10H13NO5S2/c1-16-10(13)8-6-7(18(11,14)15)2-3-9(8)17-5-4-12/h2-3,6,12H,4-5H2,1H3,(H2,11,14,15)