3-[[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[[2-(dimethylamino)-2-oxo-ethyl]sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[[2-(dimethylamino)-2-oxoethyl]sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[[2-(dimethylamino)-2-oxoethyl]sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[[2-(dimethylamino)-2-keto-ethyl]sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCC(=O)N(C)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCC(=O)N(C)C)C

InChI

InChI=1S/C13H18N2O5S/c1-8-5-10(13(17)18)6-11(9(8)2)21(19,20)14-7-12(16)15(3)4/h5-6,14H,7H2,1-4H3,(H,17,18)