4-cyano-5-methylsulfonyl-thiophene-2-carboxylic acid

Systemtic Name: 4-cyano-5-methylsulfonyl-thiophene-2-carboxylic acid Openeye Name: 4-cyano-5-methylsulfonyl-thiophene-2-carboxylic acid CAS Name: 4-cyano-5-methylsulfonyl-2-thiophenecarboxylic acid IUPAC Name: 4-cyano-5-methylsulfonylthiophene-2-carboxylic acid Traditional Name: 4-cyano-5-mesyl-2-thenoic acid Formula: C7H5NO4S2 MolecularWeight: 231.2489

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(S1)C(=O)O)C#N

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(S1)C(=O)O)C#N

InChI

InChI=1S/C7H5NO4S2/c1-14(11,12)7-4(3-8)2-5(13-7)6(9)10/h2H,1H3,(H,9,10)