4-[[1-(dimethylamino)-1-oxidanylidene-propan-2-yl]sulfamoylmethyl]benzoic acid

Systemtic Name: 4-[[1-(dimethylamino)-1-oxidanylidene-propan-2-yl]sulfamoylmethyl]benzoic acid Openeye Name: 4-[[2-(dimethylamino)-1-methyl-2-oxo-ethyl]sulfamoylmethyl]benzoic acid CAS Name: 4-[[1-(dimethylamino)-1-oxopropan-2-yl]sulfamoylmethyl]benzoic acid IUPAC Name: 4-[[1-(dimethylamino)-1-oxopropan-2-yl]sulfamoylmethyl]benzoic acid Traditional Name: 4-[[2-(dimethylamino)-2-keto-1-methyl-ethyl]sulfamoylmethyl]benzoic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)NS(=O)(=O)CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C(=O)N(C)C)NS(=O)(=O)CC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-9(12(16)15(2)3)14-21(19,20)8-10-4-6-11(7-5-10)13(17)18/h4-7,9,14H,8H2,1-3H3,(H,17,18)