Trisodium 3-[4-[[5-[(4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphonatophenyl]Azo]-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-1-Yl]Naphthalene-1,5-Disulphonate
[CAS# 13305-94-7]

Identification

• Name: Trisodium 3-[4-[[5-[(4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphonatophenyl]Azo]-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-1-Yl]Naphthalene-1,5-Disulphonate
• Synonyms: Trisodium 3-[4-[5-[(4-Amino-6-Chloro-S-Triazin-2-Yl)Amino]-2-Sulfonato-Phenyl]Azo-5-Keto-3-Methyl-4H-Pyrazol-1-Yl]Naphthalene-1,5-Disulfonate; Trisodium 3-[4-[5-[(4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfonato-Phenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Naphthalene-1,5-Disulfonate; Trisodium 3-[4-[5-[(4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfonatophenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Naphthalene-1,5-Disulfonate
• Molecular Formula: C₂₃H₁₅ClN₉Na₃O₁₀S₃
• Molecular Weight: 778.03
• CAS Registry Number: 13305-94-7
• EINECS: 236-330-9
• SMILES: C1=C5C(=C([S]([O-])(=O)=O)C=C1N4N=C(C(N=NC2=CC(=CC=C2[S]([O-])(=O)=O)NC3=NC(=NC(=N3)Cl)N)C4=O)C)C=CC=C5[S]([O-])(=O)=O.[Na+].[Na+].[Na+]
• InChI: 1S/C23H18ClN9O10S3.3Na/c1-10-19(31-30-15-7-11(5-6-17(15)45(38,39)40)26-23-28-21(24)27-22(25)29-23)20(34)33(32-10)12-8-14-13(18(9-12)46(41,42)43)3-2-4-16(14)44(35,36)37;;;/h2-9,19H,1H3,(H,35,36,37)(H,38,39,40)(H,41,42,43)(H3,25,26,27,28,29);;;/q;3*+1/p-3
• InChIKey: AAMYCVULITZDFH-UHFFFAOYSA-K