Pentasodium 2-[[4-Chloro-6-[[8-Hydroxy-3,6-Disulphonato-7-[(2-Sulphonatophenyl)Azo]-1-Naphthyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-5-Sulphonatobenzoate
[CAS# 94006-25-4]

Identification

• Name: Pentasodium 2-[[4-Chloro-6-[[8-Hydroxy-3,6-Disulphonato-7-[(2-Sulphonatophenyl)Azo]-1-Naphthyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-5-Sulphonatobenzoate
• Synonyms: Pentasodium 2-[[4-Chloro-6-[[(7E)-8-Oxo-3,6-Disulfonato-7-[(2-Sulfonatophenyl)Hydrazono]-1-Naphthyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-5-Sulfonato-Benzoate; Pentasodium 2-[[4-Chloro-6-[[(7E)-8-Oxo-3,6-Disulfonato-7-[(2-Sulfonatophenyl)Hydrazono]-1-Naphthyl]A
• Molecular Formula: C₂₆H₁₃ClN₇Na₅O₁₅S₄
• Molecular Weight: 942.07
• CAS Registry Number: 94006-25-4
• EINECS: 301-362-5
• SMILES: C3=C([S]([O-])(=O)=O)C=C(NC1=NC(=NC(=N1)NC2=C(C=C([S]([O-])(=O)=O)C=C2)C([O-])=O)Cl)C5=C3C=C([S]([O-])(=O)=O)/C(=N/NC4=CC=CC=C4[S]([O-])(=O)=O)C5=O.[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C26H18ClN7O15S4.5Na/c27-24-30-25(28-15-6-5-12(50(38,39)40)9-14(15)23(36)37)32-26(31-24)29-17-10-13(51(41,42)43)7-11-8-19(53(47,48)49)21(22(35)20(11)17)34-33-16-3-1-2-4-18(16)52(44,45)46;;;;;/h1-10,33H,(H,36,37)(H,38,39,40)(H,41,42,43)(H,44,45,46)(H,47,
• InChIKey: FBWBCYUMFMOPAU-NLNYUBOCSA-I