3-chloranyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylic acid

Systemtic Name: 3-chloranyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylic acid Openeye Name: 3-chloro-4-isopropylsulfonyl-thiophene-2-carboxylic acid CAS Name: 3-chloro-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid IUPAC Name: 3-chloro-4-propan-2-ylsulfonylthiophene-2-carboxylic acid Traditional Name: 3-chloro-4-isopropylsulfonyl-2-thenoic acid Formula: C8H9ClO4S2 MolecularWeight: 268.73766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CSC(=C1Cl)C(=O)O

Isomeric SMILES

CC(C)S(=O)(=O)C1=CSC(=C1Cl)C(=O)O

InChI

InChI=1S/C8H9ClO4S2/c1-4(2)15(12,13)5-3-14-7(6(5)9)8(10)11/h3-4H,1-2H3,(H,10,11)