3-methyl-4-propylsulfonyl-thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-4-propylsulfonyl-thiophene-2-carboxylic acid Openeye Name: 3-methyl-4-propylsulfonyl-thiophene-2-carboxylic acid CAS Name: 3-methyl-4-propylsulfonyl-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-4-propylsulfonylthiophene-2-carboxylic acid Traditional Name: 3-methyl-4-propylsulfonyl-2-thenoic acid Formula: C9H12O4S2 MolecularWeight: 248.31918

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CSC(=C1C)C(=O)O

Isomeric SMILES

CCCS(=O)(=O)C1=CSC(=C1C)C(=O)O

InChI

InChI=1S/C9H12O4S2/c1-3-4-15(12,13)7-5-14-8(6(7)2)9(10)11/h5H,3-4H2,1-2H3,(H,10,11)