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

Systemtic Name: 5-iodanyl-2-methylsulfonyl-thiophene-3-carboxylic acid Openeye Name: 5-iodo-2-methylsulfonyl-thiophene-3-carboxylic acid CAS Name: 5-iodo-2-methylsulfonyl-3-thiophenecarboxylic acid IUPAC Name: 5-iodo-2-methylsulfonylthiophene-3-carboxylic acid Traditional Name: 5-iodo-2-mesyl-3-thenoic acid Formula: C6H5IO4S2 MolecularWeight: 332.13597

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(S1)I)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(S1)I)C(=O)O

InChI

InChI=1S/C6H5IO4S2/c1-13(10,11)6-3(5(8)9)2-4(7)12-6/h2H,1H3,(H,8,9)