sodium [(3E)-3-[[2-methoxy-5-methyl-4-[(7-oxidanidylperoxysulfanyl-5-oxidanyl-naphthalen-2-yl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-7-phenylazanyl-naphthalen-2-yl] methanesulfonate

Systemtic Name: sodium [(3E)-3-[[2-methoxy-5-methyl-4-[(7-oxidanidylperoxysulfanyl-5-oxidanyl-naphthalen-2-yl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-7-phenylazanyl-naphthalen-2-yl] methanesulfonate Openeye Name: sodium [(3E)-7-anilino-3-[[4-[(5-hydroxy-7-oxidoperoxysulfanyl-2-naphthyl)azo]-2-methoxy-5-methyl-phenyl]hydrazono]-4-oxo-2-naphthyl] methanesulfonate CAS Name: sodium methanesulfonic acid [(3E)-7-anilino-3-[[4-[[5-hydroxy-7-(oxidodioxythio)-2-naphthalenyl]azo]-2-methoxy-5-methylphenyl]hydrazinylidene]-4-oxo-2-naphthalenyl] ester IUPAC Name: sodium [(3E)-7-anilino-3-[[4-[(5-hydroxy-7-oxidoperoxysulfanylnaphthalen-2-yl)diazenyl]-2-methoxy-5-methylphenyl]hydrazinylidene]-4-oxonaphthalen-2-yl] methanesulfonate Traditional Name: sodium methanesulfonic acid [(3E)-7-anilino-3-[[4-[[5-hydroxy-7-(oxidoperoxythio)-2-naphthyl]azo]-2-methoxy-5-methyl-phenyl]hydrazono]-4-keto-2-naphthyl] ester Formula: C35H28N5NaO9S2 MolecularWeight: 749.74469

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=NC2=CC3=CC(=CC(=C3C=C2)O)SOO[O-])OC)NN=C4C(=CC5=C(C4=O)C=CC(=C5)NC6=CC=CC=C6)OS(=O)(=O)C.[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1N=NC2=CC3=CC(=CC(=C3C=C2)O)SOO[O-])OC)N/N=C/4\C(=CC5=C(C4=O)C=CC(=C5)NC6=CC=CC=C6)OS(=O)(=O)C.[Na+]

InChI

InChI=1S/C35H29N5O9S2.Na/c1-20-13-30(32(46-2)19-29(20)38-37-25-10-11-27-21(15-25)16-26(18-31(27)41)50-49-48-43)39-40-34-33(47-51(3,44)45)17-22-14-24(9-12-28(22)35(34)42)36-23-7-5-4-6-8-23;/h4-19,36,39,41,43H,1-3H3;/q;+1/p-1/b38-37?,40-34+;