3-tert-butylsulfonylthiophene-2-carboxylic acid

Systemtic Name: 3-tert-butylsulfonylthiophene-2-carboxylic acid Openeye Name: 3-tert-butylsulfonylthiophene-2-carboxylic acid CAS Name: 3-tert-butylsulfonyl-2-thiophenecarboxylic acid IUPAC Name: 3-tert-butylsulfonylthiophene-2-carboxylic acid Traditional Name: 3-tert-butylsulfonyl-2-thenoic acid Formula: C9H12O4S2 MolecularWeight: 248.31918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C1=C(SC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)S(=O)(=O)C1=C(SC=C1)C(=O)O

InChI

InChI=1S/C9H12O4S2/c1-9(2,3)15(12,13)6-4-5-14-7(6)8(10)11/h4-5H,1-3H3,(H,10,11)