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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)NC2=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)OS(=O)NC2=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)41-45(36)33-24-16-22(46(37,38)39)13-18-14-26(44-43-42-35)28(29(34)27(18)24)32-31-23-15-19(30)9-12-25(23)40-20-5-3-2-4-6-20;;/h2-16,31,33,35H,1H3,(H,37,38,39);;/q;2*+1/p-2/b32-28-;;