3-methylsulfonyl-2-(methylsulfonylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylic acid

Systemtic Name: 3-methylsulfonyl-2-(methylsulfonylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylic acid Openeye Name: 4-hydroxy-3-methylsulfonyl-2-(methylsulfonylmethyl)-5-oxo-furan-2-carboxylic acid CAS Name: 4-hydroxy-3-methylsulfonyl-2-(methylsulfonylmethyl)-5-oxo-2-furancarboxylic acid IUPAC Name: 4-hydroxy-3-methylsulfonyl-2-(methylsulfonylmethyl)-5-oxofuran-2-carboxylic acid Traditional Name: 4-hydroxy-5-keto-3-mesyl-2-(mesylmethyl)-2-furoic acid Formula: C8H10O9S2 MolecularWeight: 314.2896

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1(C(=C(C(=O)O1)O)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CS(=O)(=O)CC1(C(=C(C(=O)O1)O)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C8H10O9S2/c1-18(13,14)3-8(7(11)12)5(19(2,15)16)4(9)6(10)17-8/h9H,3H2,1-2H3,(H,11,12)