4-methyl-3-(3-methylsulfonyloxy-4-oxidanyl-butyl)thiophene-2-carboxylic acid

Systemtic Name: 4-methyl-3-(3-methylsulfonyloxy-4-oxidanyl-butyl)thiophene-2-carboxylic acid Openeye Name: 3-(4-hydroxy-3-methylsulfonyloxy-butyl)-4-methyl-thiophene-2-carboxylic acid CAS Name: 3-(4-hydroxy-3-methylsulfonyloxybutyl)-4-methyl-2-thiophenecarboxylic acid IUPAC Name: 3-(4-hydroxy-3-methylsulfonyloxybutyl)-4-methylthiophene-2-carboxylic acid Traditional Name: 3-(4-hydroxy-3-methylsulfonyloxy-butyl)-4-methyl-2-thenoic acid Formula: C11H16O6S2 MolecularWeight: 308.37114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1CCC(CO)OS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=CSC(=C1CCC(CO)OS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C11H16O6S2/c1-7-6-18-10(11(13)14)9(7)4-3-8(5-12)17-19(2,15)16/h6,8,12H,3-5H2,1-2H3,(H,13,14)