2-(2-methoxyethylsulfanyl)-5-sulfamoyl-benzoic acid

Systemtic Name: 2-(2-methoxyethylsulfanyl)-5-sulfamoyl-benzoic acid Openeye Name: 2-(2-methoxyethylsulfanyl)-5-sulfamoyl-benzoic acid CAS Name: 2-(2-methoxyethylthio)-5-sulfamoylbenzoic acid IUPAC Name: 2-(2-methoxyethylsulfanyl)-5-sulfamoylbenzoic acid Traditional Name: 2-(2-methoxyethylthio)-5-sulfamoyl-benzoic acid Formula: C10H13NO5S2 MolecularWeight: 291.34392

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)O

Isomeric SMILES

COCCSC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)O

InChI

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