methyl 4-cyano-5-methylsulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-methylsulfonyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-methylsulfonyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-methylsulfonyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-methylsulfonylthiophene-2-carboxylate Traditional Name: 4-cyano-5-mesyl-thiophene-2-carboxylic acid methyl ester Formula: C8H7NO4S2 MolecularWeight: 245.27548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)S(=O)(=O)C)C#N

Isomeric SMILES

COC(=O)C1=CC(=C(S1)S(=O)(=O)C)C#N

InChI

InChI=1S/C8H7NO4S2/c1-13-7(10)6-3-5(4-9)8(14-6)15(2,11)12/h3H,1-2H3