4-(diethylamino)-3-(methylsulfamoyl)benzoic acid

Systemtic Name: 4-(diethylamino)-3-(methylsulfamoyl)benzoic acid Openeye Name: 4-(diethylamino)-3-(methylsulfamoyl)benzoic acid CAS Name: 4-(diethylamino)-3-(methylsulfamoyl)benzoic acid IUPAC Name: 4-(diethylamino)-3-(methylsulfamoyl)benzoic acid Traditional Name: 4-(diethylamino)-3-(methylsulfamoyl)benzoic acid Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4S/c1-4-14(5-2)10-7-6-9(12(15)16)8-11(10)19(17,18)13-3/h6-8,13H,4-5H2,1-3H3,(H,15,16)