disodium (6E)-6-[(5-chloranyl-2-phenoxy-phenyl)hydrazinylidene]-4-[(4-methylphenyl)sulfanylperoxyamino]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: disodium (6E)-6-[(5-chloranyl-2-phenoxy-phenyl)hydrazinylidene]-4-[(4-methylphenyl)sulfanylperoxyamino]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate Openeye Name: disodium (6E)-6-[(5-chloro-2-phenoxy-phenyl)hydrazono]-7-oxidoperoxysulfanyl-5-oxo-4-(p-tolylsulfanylperoxyamino)naphthalene-2-sulfonate CAS Name: disodium (6E)-6-[(5-chloro-2-phenoxyphenyl)hydrazinylidene]-4-[[(4-methylphenyl)thio]dioxyamino]-7-(oxidodioxythio)-5-oxo-2-naphthalenesulfonate IUPAC Name: disodium (6E)-6-[(5-chloro-2-phenoxyphenyl)hydrazinylidene]-4-[(4-methylphenyl)sulfanylperoxyamino]-7-oxidoperoxysulfanyl-5-oxonaphthalene-2-sulfonate Traditional Name: disodium (6E)-6-[(5-chloro-2-phenoxy-phenyl)hydrazono]-5-keto-7-(oxidoperoxythio)-4-[(p-tolylthio)peroxyamino]naphthalene-2-sulfonate Formula: C29H20ClN3Na2O10S3 MolecularWeight: 748.11074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SOONC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=NNC4=C(C=CC(=C4)Cl)OC5=CC=CC=C5)C3=O)SOO[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)SOONC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N/NC4=C(C=CC(=C4)Cl)OC5=CC=CC=C5)/C3=O)SOO[O-].[Na+].[Na+]

InChI

InChI=1S/C29H22ClN3O10S3.2Na/c1-17-7-10-21(11-8-17)44-42-40-33-24-16-22(46(36,37)38)13-18-14-26(45-43-41-35)28(29(34)27(18)24)32-31-23-15-19(30)9-12-25(23)39-20-5-3-2-4-6-20;;/h2-16,31,33,35H,1H3,(H,36,37,38);;/q;2*+1/p-2/b32-28-;;