3-[[[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-sulfamoyl]methyl]benzoic acid

Systemtic Name: 3-[[[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-sulfamoyl]methyl]benzoic acid Openeye Name: 3-[[[2-(dimethylamino)-2-oxo-ethyl]-methyl-sulfamoyl]methyl]benzoic acid CAS Name: 3-[[[2-(dimethylamino)-2-oxoethyl]-methylsulfamoyl]methyl]benzoic acid IUPAC Name: 3-[[[2-(dimethylamino)-2-oxoethyl]-methylsulfamoyl]methyl]benzoic acid Traditional Name: 3-[[[2-(dimethylamino)-2-keto-ethyl]-methyl-sulfamoyl]methyl]benzoic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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