Trisodium 5-amino-3-{[4-({4-[(2-amino-8-hydroxy-6-sulfonato-1-naphthyl)diazenyl]benzoyl}amino)phenyl]diazenyl}-4-hydroxy-2,7-naphthalenedisulfonate
[CAS# 85721-13-7]

Identification

• Name: Trisodium 5-amino-3-{[4-({4-[(2-amino-8-hydroxy-6-sulfonato-1-naphthyl)diazenyl]benzoyl}amino)phenyl]diazenyl}-4-hydroxy-2,7-naphthalenedisulfonate
• Synonyms: trisodium 5-amino-3-[[4-[[4-[(2-amino-8-hydroxy-6-sulphonato-1-naphthyl)azo]benzoyl]amino]phenyl]azo]-4-hydroxynaphthalene-2,7-disulphonate
• Molecular Formula: C₃₃H₂₂N₇Na₃O₁₂S₃
• Molecular Weight: 873.73
• CAS Registry Number: 85721-13-7
• EINECS: 288-423-9
• SMILES: [Na+].[Na+].[Na+].[O-]S(=O)(=O)c1cc(O)c6c(c1)ccc(N)c6N=Nc2ccc(cc2)C(=O)Nc3ccc(cc3)N=Nc5c(cc4cc(cc(N)c4c5O)S([O-])(=O)=O)S([O-])(=O)=O
• InChI: 1S/C33H25N7O12S3.3Na/c34-24-10-3-17-11-23(54(47,48)49)15-26(41)29(17)30(24)39-37-20-4-1-16(2-5-20)33(43)36-19-6-8-21(9-7-19)38-40-31-27(55(50,51)52)13-18-12-22(53(44,45)46)14-25(35)28(18)32(31)42;;;/h1-15,41-42H,34-35H2,(H,36,43)(H,44,45,46)(H,47,48,49)(H,50,51,52);;;/q;3*+1/p-3
• InChIKey: SNPQCBOTHNEHBK-UHFFFAOYSA-K