Trisodium 4-[[5-[[4-(4-Butylphenoxy)-6-Chloro-1,3,5-Triazin-2-Yl]Amino]-2-Sulphonatophenyl]Azo]-4,5-Dihydro-5-Oxo-1-(4-Sulphonatophenyl)-1H-Pyrrole-3-Carboxylate
[CAS# 97574-43-1]

Identification

• Name: Trisodium 4-[[5-[[4-(4-Butylphenoxy)-6-Chloro-1,3,5-Triazin-2-Yl]Amino]-2-Sulphonatophenyl]Azo]-4,5-Dihydro-5-Oxo-1-(4-Sulphonatophenyl)-1H-Pyrrole-3-Carboxylate
• Synonyms: Trisodium 4-[5-[[4-(4-Butylphenoxy)-6-Chloro-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Azo-5-Oxo-1-(4-Sulfonatophenyl)-4H-Pyrrole-3-Carboxylate; Trisodium 4-[5-[[4-(4-Butylphenoxy)-6-Chloro-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonatophenyl]Azo-5-Oxo-1-(4-Sulf
• Molecular Formula: C₃₀H₂₃ClN₇Na₃O₁₀S₂
• Molecular Weight: 810.09
• CAS Registry Number: 97574-43-1
• EINECS: 307-253-9
• SMILES: C5=C(N4C(=O)C(N=NC1=C([S]([O-])(=O)=O)C=CC(=C1)NC2=NC(=NC(=N2)OC3=CC=C(C=C3)CCCC)Cl)C(=C4)C([O-])=O)C=CC(=C5)[S]([O-])(=O)=O.[Na+].[Na+].[Na+]
• InChI: 1S/C30H26ClN7O10S2.3Na/c1-2-3-4-17-5-10-20(11-6-17)48-30-34-28(31)33-29(35-30)32-18-7-14-24(50(45,46)47)23(15-18)36-37-25-22(27(40)41)16-38(26(25)39)19-8-12-21(13-9-19)49(42,43)44;;;/h5-16,25H,2-4H2,1H3,(H,40,41)(H,42,43,44)(H,45,46,47)(H,32,33,34,35);;;/
• InChIKey: PZBVTCVOAVDFJQ-UHFFFAOYSA-K