5-methyl-2-methylsulfonyl-thiophene-3-carboxylic acid

Systemtic Name: 5-methyl-2-methylsulfonyl-thiophene-3-carboxylic acid Openeye Name: 5-methyl-2-methylsulfonyl-thiophene-3-carboxylic acid CAS Name: 5-methyl-2-methylsulfonyl-3-thiophenecarboxylic acid IUPAC Name: 5-methyl-2-methylsulfonylthiophene-3-carboxylic acid Traditional Name: 2-mesyl-5-methyl-3-thenoic acid Formula: C7H8O4S2 MolecularWeight: 220.26602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C7H8O4S2/c1-4-3-5(6(8)9)7(12-4)13(2,10)11/h3H,1-2H3,(H,8,9)