Trisodium 2-{[4-({4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-7-sulfonato-1-naphthyl}diazenyl)-2,5-dimethylphenyl]diazenyl}-1,4-benzenedisulfonate
[CAS# 85631-75-0]

Identification

• Name: Trisodium 2-{[4-({4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-7-sulfonato-1-naphthyl}diazenyl)-2,5-dimethylphenyl]diazenyl}-1,4-benzenedisulfonate
• Synonyms: trisodium 2-[[4-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-7-sulphonato-1-naphthyl]azo]-2,5-dimethylphenyl]azo]benzene-1,4-disulphonate
• Molecular Formula: C₂₇H₁₇Cl₂N₈Na₃O₉S₃
• Molecular Weight: 833.54
• CAS Registry Number: 85631-75-0
• EINECS: 288-023-4
• SMILES: [Na+].[Na+].[Na+].Clc5nc(Nc3ccc(N=Nc2cc(C)c(N=Nc1cc(ccc1S([O-])(=O)=O)S([O-])(=O)=O)cc2C)c4cc(ccc34)S([O-])(=O)=O)nc(Cl)n5
• InChI: 1S/C27H20Cl2N8O9S3.3Na/c1-13-10-22(36-37-23-12-16(48(41,42)43)4-8-24(23)49(44,45)46)14(2)9-21(13)35-34-20-7-6-19(30-27-32-25(28)31-26(29)33-27)17-5-3-15(11-18(17)20)47(38,39)40;;;/h3-12H,1-2H3,(H,38,39,40)(H,41,42,43)(H,44,45,46)(H,30,31,32,33);;;/q;3*+1/p-3
• InChIKey: FUGDXAAYCZQYSW-UHFFFAOYSA-K