sodium (5E)-4-methyl-5-[(5-oxidanidylperoxysulfanyl-2-oxidanyl-phenyl)hydrazinylidene]-2,6-bis(oxidanylidene)pyridine-3-carbonitrile

Systemtic Name: sodium (5E)-4-methyl-5-[(5-oxidanidylperoxysulfanyl-2-oxidanyl-phenyl)hydrazinylidene]-2,6-bis(oxidanylidene)pyridine-3-carbonitrile Openeye Name: sodium (5E)-5-[(2-hydroxy-5-oxidoperoxysulfanyl-phenyl)hydrazono]-4-methyl-2,6-dioxo-pyridine-3-carbonitrile CAS Name: sodium 3-[(2E)-2-(5-cyano-4-methyl-2,6-dioxo-3-pyridinylidene)hydrazinyl]-4-hydroxybenzenesulfenic acid oxidooxy ester IUPAC Name: sodium (5E)-5-[(2-hydroxy-5-oxidoperoxysulfanylphenyl)hydrazinylidene]-4-methyl-2,6-dioxopyridine-3-carbonitrile Traditional Name: sodium (5E)-5-[[2-hydroxy-5-(oxidoperoxythio)phenyl]hydrazono]-2,6-diketo-4-methyl-nicotinonitrile Formula: C13H9N4NaO6S MolecularWeight: 372.28853

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)C1=NNC2=C(C=CC(=C2)SOO[O-])O)C#N.[Na+]

Isomeric SMILES

CC\1=C(C(=O)NC(=O)/C1=N/NC2=C(C=CC(=C2)SOO[O-])O)C#N.[Na+]

InChI

InChI=1S/C13H10N4O6S.Na/c1-6-8(5-14)12(19)15-13(20)11(6)17-16-9-4-7(24-23-22-21)2-3-10(9)18;/h2-4,16,18,21H,1H3,(H,15,19,20);/q;+1/p-1/b17-11+;