3-chloranyl-4-methylsulfonyl-thiophene-2-carboxylic acid

Systemtic Name: 3-chloranyl-4-methylsulfonyl-thiophene-2-carboxylic acid Openeye Name: 3-chloro-4-methylsulfonyl-thiophene-2-carboxylic acid CAS Name: 3-chloro-4-methylsulfonyl-2-thiophenecarboxylic acid IUPAC Name: 3-chloro-4-methylsulfonylthiophene-2-carboxylic acid Traditional Name: 3-chloro-4-mesyl-2-thenoic acid Formula: C6H5ClO4S2 MolecularWeight: 240.6845

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CSC(=C1Cl)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CSC(=C1Cl)C(=O)O

InChI

InChI=1S/C6H5ClO4S2/c1-13(10,11)3-2-12-5(4(3)7)6(8)9/h2H,1H3,(H,8,9)