Trisodium 3-[2-Acetamido-4-[[4-Chloro-6-(2-Sulfonatoethylamino)-1,3,5-Triazin-2-Yl]Amino]Phenyl]Diazenylnaphthalene-1,5-Disulfonate
[CAS# 72829-27-7]

Identification

• Name: Trisodium 3-[2-Acetamido-4-[[4-Chloro-6-(2-Sulfonatoethylamino)-1,3,5-Triazin-2-Yl]Amino]Phenyl]Diazenylnaphthalene-1,5-Disulfonate
• Synonyms: Trisodium 3-[2-Acetamido-4-[[4-Chloro-6-(2-Sulfonatoethylamino)-1,3,5-Triazin-2-Yl]Amino]Phenyl]Azonaphthalene-1,5-Disulfonate; Trisodium 3-[2-Acetamido-4-[[4-Chloro-6-(2-Sulfonatoethylamino)-S-Triazin-2-Yl]Amino]Phenyl]Azonaphthalene-1,5-Disulfonate; 1,5-Naphthalenedisulfonic Acid, 3-((2-(Acetylamino)-4-((4-Chloro-6-((2-Sulfoethyl)Amino)-1,3,5-Triazin-2-Yl)Amino)Phenyl)Azo)-, Trisodium Salt
• Molecular Formula: C₂₃H₁₈ClN₈Na₃O₁₀S₃
• Molecular Weight: 767.05
• CAS Registry Number: 72829-27-7
• EINECS: 276-914-0
• SMILES: C1=C4C(=C([S]([O-])(=O)=O)C=C1N=NC3=CC=C(NC2=NC(=NC(=N2)NCC[S]([O-])(=O)=O)Cl)C=C3NC(=O)C)C=CC=C4[S]([O-])(=O)=O.[Na+].[Na+].[Na+]
• InChI: 1S/C23H21ClN8O10S3.3Na/c1-12(33)26-18-10-13(27-23-29-21(24)28-22(30-23)25-7-8-43(34,35)36)5-6-17(18)32-31-14-9-16-15(20(11-14)45(40,41)42)3-2-4-19(16)44(37,38)39;;;/h2-6,9-11H,7-8H2,1H3,(H,26,33)(H,34,35,36)(H,37,38,39)(H,40,41,42)(H2,25,27,28,29,30);;;/q;3*+1/p-3
• InChIKey: OHIIVMIIWKYIIL-UHFFFAOYSA-K