disodium (6Z)-4-acetamido-6-[(5-ethanoyl-2-methyl-phenyl)hydrazinylidene]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: disodium (6Z)-4-acetamido-6-[(5-ethanoyl-2-methyl-phenyl)hydrazinylidene]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate Openeye Name: disodium (6Z)-4-acetamido-6-[(5-acetyl-2-methyl-phenyl)hydrazono]-7-oxidoperoxysulfanyl-5-oxo-naphthalene-2-sulfonate CAS Name: disodium (6Z)-4-acetamido-6-[(5-acetyl-2-methylphenyl)hydrazinylidene]-7-(oxidodioxythio)-5-oxo-2-naphthalenesulfonate IUPAC Name: disodium (6Z)-4-acetamido-6-[(5-acetyl-2-methylphenyl)hydrazinylidene]-7-oxidoperoxysulfanyl-5-oxonaphthalene-2-sulfonate Traditional Name: disodium (6Z)-4-acetamido-6-[(5-acetyl-2-methyl-phenyl)hydrazono]-5-keto-7-(oxidoperoxythio)naphthalene-2-sulfonate Formula: C21H17N3Na2O9S2 MolecularWeight: 565.48392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C)NN=C2C(=CC3=CC(=CC(=C3C2=O)NC(=O)C)S(=O)(=O)[O-])SOO[O-].[Na+].[Na+]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC(=O)C)S(=O)(=O)[O-])SOO[O-].[Na+].[Na+]

InChI

InChI=1S/C21H19N3O9S2.2Na/c1-10-4-5-13(11(2)25)7-16(10)23-24-20-18(34-33-32-28)8-14-6-15(35(29,30)31)9-17(22-12(3)26)19(14)21(20)27;;/h4-9,23,28H,1-3H3,(H,22,26)(H,29,30,31);;/q;2*+1/p-2/b24-20+;;