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

Systemtic Name: 4-ethenyl-3-methyl-5-methylsulfonyl-thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-methylsulfonyl-4-vinyl-thiophene-2-carboxylic acid CAS Name: 4-ethenyl-3-methyl-5-methylsulfonyl-2-thiophenecarboxylic acid IUPAC Name: 4-ethenyl-3-methyl-5-methylsulfonylthiophene-2-carboxylic acid Traditional Name: 5-mesyl-3-methyl-4-vinyl-2-thenoic acid Formula: C9H10O4S2 MolecularWeight: 246.3033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C=C)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1C=C)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C9H10O4S2/c1-4-6-5(2)7(8(10)11)14-9(6)15(3,12)13/h4H,1H2,2-3H3,(H,10,11)