sodium (5-aminocarbonyl-1-ethyl-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl)methanesulfonate

Systemtic Name: sodium (5-aminocarbonyl-1-ethyl-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl)methanesulfonate Openeye Name: sodium (5-carbamoyl-1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridyl)methanesulfonate CAS Name: sodium (5-carbamoyl-1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)methanesulfonate IUPAC Name: sodium (5-carbamoyl-1-ethyl-2-hydroxy-4-methyl-6-oxopyridin-3-yl)methanesulfonate Traditional Name: sodium (5-carbamoyl-1-ethyl-2-hydroxy-6-keto-4-methyl-3-pyridyl)methanesulfonate Formula: C10H13N2NaO6S MolecularWeight: 312.27479

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C(C1=O)C(=O)N)C)CS(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

CCN1C(=C(C(=C(C1=O)C(=O)N)C)CS(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C10H14N2O6S.Na/c1-3-12-9(14)6(4-19(16,17)18)5(2)7(8(11)13)10(12)15;/h14H,3-4H2,1-2H3,(H2,11,13)(H,16,17,18);/q;+1/p-1