sodium 1,4-dimethyl-2-oxidanyl-6-oxidanylidene-pyridine-3-sulfonate

Systemtic Name: sodium 1,4-dimethyl-2-oxidanyl-6-oxidanylidene-pyridine-3-sulfonate Openeye Name: sodium 2-hydroxy-1,4-dimethyl-6-oxo-pyridine-3-sulfonate CAS Name: sodium 2-hydroxy-1,4-dimethyl-6-oxo-3-pyridinesulfonate IUPAC Name: sodium 2-hydroxy-1,4-dimethyl-6-oxopyridine-3-sulfonate Traditional Name: sodium 2-hydroxy-6-keto-1,4-dimethyl-pyridine-3-sulfonate Formula: C7H8NNaO5S MolecularWeight: 241.19689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1S(=O)(=O)[O-])O)C.[Na+]

Isomeric SMILES

CC1=CC(=O)N(C(=C1S(=O)(=O)[O-])O)C.[Na+]

InChI

InChI=1S/C7H9NO5S.Na/c1-4-3-5(9)8(2)7(10)6(4)14(11,12)13;/h3,10H,1-2H3,(H,11,12,13);/q;+1/p-1