(1-ethyl-3-methylsulfonyl-2-oxidanyl-6-oxidanylidene-pyridin-4-yl)methanesulfonic acid

Systemtic Name: (1-ethyl-3-methylsulfonyl-2-oxidanyl-6-oxidanylidene-pyridin-4-yl)methanesulfonic acid Openeye Name: (1-ethyl-2-hydroxy-3-methylsulfonyl-6-oxo-4-pyridyl)methanesulfonic acid CAS Name: (1-ethyl-2-hydroxy-3-methylsulfonyl-6-oxo-4-pyridinyl)methanesulfonic acid IUPAC Name: (1-ethyl-2-hydroxy-3-methylsulfonyl-6-oxopyridin-4-yl)methanesulfonic acid Traditional Name: (1-ethyl-2-hydroxy-6-keto-3-mesyl-4-pyridyl)methanesulfonic acid Formula: C9H13NO7S2 MolecularWeight: 311.33202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(C(=C1O)S(=O)(=O)C)CS(=O)(=O)O

Isomeric SMILES

CCN1C(=O)C=C(C(=C1O)S(=O)(=O)C)CS(=O)(=O)O

InChI

InChI=1S/C9H13NO7S2/c1-3-10-7(11)4-6(5-19(15,16)17)8(9(10)12)18(2,13)14/h4,12H,3,5H2,1-2H3,(H,15,16,17)