3,4-dimethyl-5-(1-oxidanylpropan-2-ylsulfamoyl)benzoic acid

Systemtic Name: 3,4-dimethyl-5-(1-oxidanylpropan-2-ylsulfamoyl)benzoic acid Openeye Name: 3-[(2-hydroxy-1-methyl-ethyl)sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-(1-hydroxypropan-2-ylsulfamoyl)-4,5-dimethylbenzoic acid IUPAC Name: 3-(1-hydroxypropan-2-ylsulfamoyl)-4,5-dimethylbenzoic acid Traditional Name: 3-[(2-hydroxy-1-methyl-ethyl)sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC(C)CO)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC(C)CO)C

InChI

InChI=1S/C12H17NO5S/c1-7-4-10(12(15)16)5-11(9(7)3)19(17,18)13-8(2)6-14/h4-5,8,13-14H,6H2,1-3H3,(H,15,16)