3,4-dimethyl-5-(3-oxidanylpropylsulfamoyl)benzoic acid

Systemtic Name: 3,4-dimethyl-5-(3-oxidanylpropylsulfamoyl)benzoic acid Openeye Name: 3-(3-hydroxypropylsulfamoyl)-4,5-dimethyl-benzoic acid CAS Name: 3-(3-hydroxypropylsulfamoyl)-4,5-dimethylbenzoic acid IUPAC Name: 3-(3-hydroxypropylsulfamoyl)-4,5-dimethylbenzoic acid Traditional Name: 3-(3-hydroxypropylsulfamoyl)-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)NCCCO)C

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO5S/c1-8-6-10(12(15)16)7-11(9(8)2)19(17,18)13-4-3-5-14/h6-7,13-14H,3-5H2,1-2H3,(H,15,16)