4-methyl-5-(2-methylsulfanylethylsulfamoyl)-2-oxidanyl-benzoic acid

Systemtic Name: 4-methyl-5-(2-methylsulfanylethylsulfamoyl)-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-methyl-5-(2-methylsulfanylethylsulfamoyl)benzoic acid CAS Name: 2-hydroxy-4-methyl-5-[2-(methylthio)ethylsulfamoyl]benzoic acid IUPAC Name: 2-hydroxy-4-methyl-5-(2-methylsulfanylethylsulfamoyl)benzoic acid Traditional Name: 2-hydroxy-4-methyl-5-[2-(methylthio)ethylsulfamoyl]benzoic acid Formula: C11H15NO5S2 MolecularWeight: 305.3705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(=O)O)S(=O)(=O)NCCSC

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(=O)O)S(=O)(=O)NCCSC

InChI

InChI=1S/C11H15NO5S2/c1-7-5-9(13)8(11(14)15)6-10(7)19(16,17)12-3-4-18-2/h5-6,12-13H,3-4H2,1-2H3,(H,14,15)