Hexasodium 4,4'-Bis[[4-Chloro-6-[[3-[[1-(2,5-Dichloro-4-Sulphonatophenyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-4-Yl]Azo]-4-Sulphonatophenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]Stilbene-2,2'-Disulphonate
[CAS# 70224-83-8]

Identification

• Name: Hexasodium 4,4'-Bis[[4-Chloro-6-[[3-[[1-(2,5-Dichloro-4-Sulphonatophenyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-4-Yl]Azo]-4-Sulphonatophenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]Stilbene-2,2'-Disulphonate
• Synonyms: Benzenesulfonic Acid, 2,2'-(1,2-Ethenediyl)Bis(5-((4-Chloro-6-((3-((1-(2,5-Dichloro-4-Sulfophenyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-4-Yl)Azo)-4-Sulfophenyl)Amino)-1,3,5-Triazin-2-Yl)Amino)-, Hexasodium Salt; Hexasodium 4,4'-Bis((4-Chloro-6-((3-((1-(2,5-Dichloro-4-Sulphonatophenyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-4-Yl)Azo)-4-Sulphonatophenyl)Amino)-1,3,5-Triazin-2-Yl)Amino)Stilbene-2,2'-Disulphonate
• Molecular Formula: C₅₂H₃₀Cl₆N₁₈Na₆O₂₀S₆
• Molecular Weight: 1769.93
• CAS Registry Number: 70224-83-8
• EINECS: 274-454-5
• SMILES: C(=C\C1=CC=C(C=C1[S](=O)(=O)[O-])NC2=NC(=NC(=N2)NC3=CC=C(C(=C3)N=NC4C(=NN(C4=O)C5=CC(=C(C=C5Cl)[S](=O)(=O)[O-])Cl)C)[S](=O)(=O)[O-])Cl)/C6=CC=C(C=C6[S](=O)(=O)[O-])NC7=NC(=NC(=N7)NC8=CC=C(C(=C8)N=NC9C(=NN(C9=O)C%10=CC(=C(C=C%10Cl)[S](=O)(=O)[O-])Cl)C)[S](=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C52H36Cl6N18O20S6.6Na/c1-21-43(45(77)75(73-21)35-17-31(55)41(19-29(35)53)101(91,92)93)71-69-33-13-25(9-11-37(33)97(79,80)81)59-49-63-47(57)65-51(67-49)61-27-7-5-23(39(15-27)99(85,86)87)3-4-24-6-8-28(16-40(24)100(88,89)90)62-52-66-48(58)64-50(68-52)60-26-10-12-38(98(82,83)84)34(14-26)70-72-44-22(2)74-76(46(44)78)36-18-32(56)42(20-30(36)54)102(94,95)96;;;;;;/h3-20,43-44H,1-2H3,(H,79,80,81)(H,82,83,84)(H,85,86,87)(H,88,89,90)(H,91,92,93)(H,94,95,96)(H2,59,61,63,65,67)(H2,60,62,64,66,68);;;;;;/q;6*+1/p-6/b4-3+,71-69?,72-70?
• InChIKey: KKPMTXMREZGVGJ-GQJXTSOFSA-H