Trisodium 5-{[4'-({8-[(2,4-Diaminophenyl)Diazenyl]-1-Hydroxy-3,6-Disulfonato-2-Naphthyl}Diazenyl)-4-Biphenylyl]Diazenyl}-2-Hydroxybenzoate
[CAS# 4623-91-0]

Identification

• Name: Trisodium 5-{[4'-({8-[(2,4-Diaminophenyl)Diazenyl]-1-Hydroxy-3,6-Disulfonato-2-Naphthyl}Diazenyl)-4-Biphenylyl]Diazenyl}-2-Hydroxybenzoate
• Synonyms: Benzoic acid, 5-[[4'-[[8-[(2,4-diaminophenyl)azo]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo][1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, trisodium salt
• Molecular Formula: C₃₅H₂₃N₈Na₃O₁₀S₂
• Molecular Weight: 848.70
• CAS Registry Number: 4623-91-0
• SMILES: c1cc(ccc1c2ccc(cc2)N=Nc3c(cc4cc(cc(c4c3O)N=Nc5ccc(cc5N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N=Nc6ccc(c(c6)C(=O)[O-])O.[Na+].[Na+].[Na+]
• InChI: 1S/C35H26N8O10S2.3Na/c36-21-5-11-28(27(37)15-21)41-42-29-17-25(54(48,49)50)13-20-14-31(55(51,52)53)33(34(45)32(20)29)43-39-23-8-3-19(4-9-23)18-1-6-22(7-2-18)38-40-24-10-12-30(44)26(16-24)35(46)47;;;/h1-17,44-45H,36-37H2,(H,46,47)(H,48,49,50)(H,51,52,53);;;/q;3*+1/p-3
• InChIKey: WWZAZAQRDIPCHJ-UHFFFAOYSA-K