Tetrasodium 2-[[8-[[4-Chloro-6-[[4-(6-Methyl-5-Sulphonatobenzothiazol-2-Yl)Phenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-1-Hydroxy-3,6-Disulphonato-2-Naphthyl]Azo]Benzoate
[CAS# 94231-76-2]

Identification

• Name: Tetrasodium 2-[[8-[[4-Chloro-6-[[4-(6-Methyl-5-Sulphonatobenzothiazol-2-Yl)Phenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-1-Hydroxy-3,6-Disulphonato-2-Naphthyl]Azo]Benzoate
• Synonyms: Tetrasodium 2-[(N'e)-N'-[8-[[4-Chloro-6-[[4-(6-Methyl-5-Sulfonato-1,3-Benzothiazol-2-Yl)Phenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-1-Oxo-3,6-Disulfonato-2-Naphthylidene]Hydrazino]Benzoate; Tetrasodium 2-[(N'e)-N'-[8-[[4-Chloro-6-[[4-(6-Methyl-5-Sulfonato-1,3-
• Molecular Formula: C₃₄H₁₉ClN₈Na₄O₁₂S₄
• Molecular Weight: 987.22
• CAS Registry Number: 94231-76-2
• EINECS: 303-896-4
• SMILES: C5=C([S]([O-])(=O)=O)C=C(NC1=NC(=NC(=N1)NC4=CC=C(C2=NC3=C(S2)C=C(C(=C3)[S]([O-])(=O)=O)C)C=C4)Cl)C7=C5C=C([S]([O-])(=O)=O)/C(=N/NC6=CC=CC=C6C([O-])=O)C7=O.[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C34H23ClN8O12S4.4Na/c1-15-10-24-22(14-25(15)58(50,51)52)37-30(56-24)16-6-8-18(9-7-16)36-33-39-32(35)40-34(41-33)38-23-13-19(57(47,48)49)11-17-12-26(59(53,54)55)28(29(44)27(17)23)43-42-21-5-3-2-4-20(21)31(45)46;;;;/h2-14,42H,1H3,(H,45,46)(H,47,48,49)(H,
• InChIKey: KOKBAHWBGBXPNT-YUKCHGGLSA-J