disodium (6Z)-4-azanyl-7-oxidanidylperoxysulfanyl-5-oxidanylidene-3-(quinolin-8-yldiazenyl)-6-(quinolin-8-ylhydrazinylidene)naphthalene-2-sulfonate

Systemtic Name: disodium (6Z)-4-azanyl-7-oxidanidylperoxysulfanyl-5-oxidanylidene-3-(quinolin-8-yldiazenyl)-6-(quinolin-8-ylhydrazinylidene)naphthalene-2-sulfonate Openeye Name: disodium (6Z)-4-amino-7-oxidoperoxysulfanyl-5-oxo-3-(8-quinolylazo)-6-(8-quinolylhydrazono)naphthalene-2-sulfonate CAS Name: disodium (6Z)-4-amino-7-(oxidodioxythio)-5-oxo-3-(8-quinolinylazo)-6-(8-quinolinylhydrazinylidene)-2-naphthalenesulfonate IUPAC Name: disodium (6Z)-4-amino-7-oxidoperoxysulfanyl-5-oxo-3-(quinolin-8-yldiazenyl)-6-(quinolin-8-ylhydrazinylidene)naphthalene-2-sulfonate Traditional Name: disodium (6Z)-4-amino-5-keto-7-(oxidoperoxythio)-3-(8-quinolylazo)-6-(8-quinolylhydrazono)naphthalene-2-sulfonate Formula: C28H17N7Na2O7S2 MolecularWeight: 673.58682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NN=C3C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=CC6=C5N=CC=C6)S(=O)(=O)[O-])SOO[O-])N=CC=C2.[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C(=C1)N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=CC6=C5N=CC=C6)S(=O)(=O)[O-])SOO[O-])N=CC=C2.[Na+].[Na+]

InChI

InChI=1S/C28H19N7O7S2.2Na/c29-23-22-17(14-21(44(38,39)40)27(23)35-33-19-10-2-6-16-8-4-12-31-25(16)19)13-20(43-42-41-37)26(28(22)36)34-32-18-9-1-5-15-7-3-11-30-24(15)18;;/h1-14,32,37H,29H2,(H,38,39,40);;/q;2*+1/p-2/b34-26+,35-33?;;