Tetrasodium 4-amino-3,6-bis({5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl}diazenyl)-5-hydroxy-2,7-naphthalenedisulfonate
[CAS# 85631-74-9]

Identification

• Name: Tetrasodium 4-amino-3,6-bis({5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl}diazenyl)-5-hydroxy-2,7-naphthalenedisulfonate
• Synonyms: tetrasodium 4-amino-3,6-bis[[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-sulphonatophenyl]azo]-5-hydroxynaphthalene-2,7-disulphonate
• Molecular Formula: C₂₈H₁₇Cl₂N₁₅Na₄O₁₃S₄
• Molecular Weight: 1062.65
• CAS Registry Number: 85631-74-9
• EINECS: 288-022-9
• SMILES: [Na+].[Na+].[Na+].[Na+].Nc6nc(Nc5ccc(c(N=Nc4c(cc3cc(c(N=Nc2cc(Nc1nc(N)nc(Cl)n1)ccc2S([O-])(=O)=O)c(N)c3c4O)S([O-])(=O)=O)S([O-])(=O)=O)c5)S([O-])(=O)=O)nc(Cl)n6
• InChI: 1S/C28H21Cl2N15O13S4.4Na/c29-23-36-25(32)40-27(38-23)34-10-1-3-14(59(47,48)49)12(7-10)42-44-20-16(61(53,54)55)5-9-6-17(62(56,57)58)21(22(46)18(9)19(20)31)45-43-13-8-11(2-4-15(13)60(50,51)52)35-28-39-24(30)37-26(33)41-28;;;;/h1-8,46H,31H2,(H,47,48,49)(H,50,51,52)(H,53,54,55)(H,56,57,58)(H3,32,34,36,38,40)(H3,33,35,37,39,41);;;;/q;4*+1/p-4
• InChIKey: ORAUROUWISTJCC-UHFFFAOYSA-J