Tetrasodium 4-Amino-6-[[5-[[4-[(3-Chlorophenyl)Amino]-6-Fluoro-1,3,5-Triazin-2-Yl]Amino]-2-Sulphonatophenyl]Azo]-5-Hydroxy-3-[(4-Sulphonatophenyl)Azo]Naphthalene-2,7-Disulphonate
[CAS# 70528-89-1]

Identification

• Name: Tetrasodium 4-Amino-6-[[5-[[4-[(3-Chlorophenyl)Amino]-6-Fluoro-1,3,5-Triazin-2-Yl]Amino]-2-Sulphonatophenyl]Azo]-5-Hydroxy-3-[(4-Sulphonatophenyl)Azo]Naphthalene-2,7-Disulphonate
• Synonyms: Tetrasodium (3E)-5-Amino-3-[[5-[[4-[(3-Chlorophenyl)Amino]-6-Fluoro-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Hydrazono]-4-Oxo-6-(4-Sulfonatophenyl)Azo-Naphthalene-2,7-Disulfonate; Tetrasodium (3E)-5-Amino-3-[[5-[[4-[(3-Chlorophenyl)Amino]-6-Fluoro-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonatophenyl]Hydrazono]-4-Oxo-6-(4-Sulfonatophenyl)Azonaphthalene-2,7-Disulfonate; Tetrasodium (3E)-5-Amino-3-[[5-[[4-[(3-Chlorophenyl)Amino]-6-Fluoro-S-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Hydrazono]-4-Keto-6-(4-Sulfonatophenyl)Azo-Naphthalene-2,7-Disulfonate
• Molecular Formula: C₃₁H₁₈ClFN₁₀Na₄O₁₃S₄
• Molecular Weight: 1013.19
• CAS Registry Number: 70528-89-1
• EINECS: 274-658-4
• SMILES: C1=C6C(=C(N)C(=C1[S]([O-])(=O)=O)N=NC2=CC=C([S]([O-])(=O)=O)C=C2)C(=O)C(=N/NC3=C([S]([O-])(=O)=O)C=CC(=C3)NC4=NC(=NC(=N4)NC5=CC(=CC=C5)Cl)F)\C(=C6)[S]([O-])(=O)=O.[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C31H22ClFN10O13S4.4Na/c32-15-2-1-3-17(12-15)35-30-37-29(33)38-31(39-30)36-18-6-9-21(58(48,49)50)20(13-18)41-43-27-23(60(54,55)56)11-14-10-22(59(51,52)53)26(25(34)24(14)28(27)44)42-40-16-4-7-19(8-5-16)57(45,46)47;;;;/h1-13,41H,34H2,(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)(H2,35,36,37,38,39);;;;/q;4*+1/p-4/b42-40?,43-27-
• InChIKey: IMSUCZSKPKCTIA-IYMVRKBWSA-J