3-[(1-methoxy-1-oxidanylidene-butan-2-yl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(1-methoxy-1-oxidanylidene-butan-2-yl)sulfamoyl]benzoic acid Openeye Name: 3-(1-methoxycarbonylpropylsulfamoyl)benzoic acid CAS Name: 3-[(1-methoxy-1-oxobutan-2-yl)sulfamoyl]benzoic acid IUPAC Name: 3-[(1-methoxy-1-oxobutan-2-yl)sulfamoyl]benzoic acid Traditional Name: 3-(1-carbomethoxypropylsulfamoyl)benzoic acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC)NS(=O)(=O)C1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CCC(C(=O)OC)NS(=O)(=O)C1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C12H15NO6S/c1-3-10(12(16)19-2)13-20(17,18)9-6-4-5-8(7-9)11(14)15/h4-7,10,13H,3H2,1-2H3,(H,14,15)