4-butan-2-ylsulfonyl-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 4-butan-2-ylsulfonyl-3-methyl-thiophene-2-carboxylic acid Openeye Name: 3-methyl-4-sec-butylsulfonyl-thiophene-2-carboxylic acid CAS Name: 4-butan-2-ylsulfonyl-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 4-butan-2-ylsulfonyl-3-methylthiophene-2-carboxylic acid Traditional Name: 3-methyl-4-sec-butylsulfonyl-2-thenoic acid Formula: C10H14O4S2 MolecularWeight: 262.34576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)S(=O)(=O)C1=CSC(=C1C)C(=O)O

Isomeric SMILES

CCC(C)S(=O)(=O)C1=CSC(=C1C)C(=O)O

InChI

InChI=1S/C10H14O4S2/c1-4-6(2)16(13,14)8-5-15-9(7(8)3)10(11)12/h5-6H,4H2,1-3H3,(H,11,12)