(5-ethanoyl-1-ethyl-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl)methanesulfonic acid

Systemtic Name: (5-ethanoyl-1-ethyl-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl)methanesulfonic acid Openeye Name: (5-acetyl-1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridyl)methanesulfonic acid CAS Name: (5-acetyl-1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)methanesulfonic acid IUPAC Name: (5-acetyl-1-ethyl-2-hydroxy-4-methyl-6-oxopyridin-3-yl)methanesulfonic acid Traditional Name: (5-acetyl-1-ethyl-2-hydroxy-6-keto-4-methyl-3-pyridyl)methanesulfonic acid Formula: C11H15NO6S MolecularWeight: 289.3049

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C(C1=O)C(=O)C)C)CS(=O)(=O)O)O

Isomeric SMILES

CCN1C(=C(C(=C(C1=O)C(=O)C)C)CS(=O)(=O)O)O

InChI

InChI=1S/C11H15NO6S/c1-4-12-10(14)8(5-19(16,17)18)6(2)9(7(3)13)11(12)15/h14H,4-5H2,1-3H3,(H,16,17,18)