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3-methylsulfonylthiophene-2-carboxylic acid

3-methylsulfonylthiophene-2-carboxylic acid

Systemtic Name:3-methylsulfonylthiophene-2-carboxylic acid
Openeye Name:3-methylsulfonylthiophene-2-carboxylic acid
CAS Name:3-methylsulfonyl-2-thiophenecarboxylic acid
IUPAC Name:3-methylsulfonylthiophene-2-carboxylic acid
Traditional Name:3-mesyl-2-thenoic acid
Formula: C6H6O4S2
MolecularWeight: 206.23944
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(SC=C1)C(=O)O


Isomeric SMILES

CS(=O)(=O)C1=C(SC=C1)C(=O)O


InChI

InChI=1S/C6H6O4S2/c1-12(9,10)4-2-3-11-5(4)6(7)8/h2-3H,1H3,(H,7,8)


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