4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfamoylmethyl]benzoic acid

Systemtic Name: 4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfamoylmethyl]benzoic acid Openeye Name: 4-[[2-(dimethylamino)-2-oxo-ethyl]sulfamoylmethyl]benzoic acid CAS Name: 4-[[2-(dimethylamino)-2-oxoethyl]sulfamoylmethyl]benzoic acid IUPAC Name: 4-[[2-(dimethylamino)-2-oxoethyl]sulfamoylmethyl]benzoic acid Traditional Name: 4-[[2-(dimethylamino)-2-keto-ethyl]sulfamoylmethyl]benzoic acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNS(=O)(=O)CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CN(C)C(=O)CNS(=O)(=O)CC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H16N2O5S/c1-14(2)11(15)7-13-20(18,19)8-9-3-5-10(6-4-9)12(16)17/h3-6,13H,7-8H2,1-2H3,(H,16,17)