Trisodium 5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-4-Hydroxy-3-[[4-[(4-Methoxyphenyl)Amino]-3-Sulphonatophenyl]Azo]Naphthalene-2,7-Disulphonate
[CAS 73398-42-2]

Identification

• Name: Trisodium 5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-4-Hydroxy-3-[[4-[(4-Methoxyphenyl)Amino]-3-Sulphonatophenyl]Azo]Naphthalene-2,7-Disulphonate
• Synonyms: Trisodium (3E)-5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-3-[[4-[(4-Methoxyphenyl)Amino]-3-Sulfonato-Phenyl]Hydrazono]-4-Oxo-Naphthalene-2,7-Disulfonate; Trisodium (3E)-5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-3-[[4-[(4-Methoxyphenyl)Amino]-3-Sulfonatophenyl]Hydrazono]-4-Oxonaphthalene-2,7-Disulfonate; Trisodium (3E)-5-[(4,6-Dichloro-S-Triazin-2-Yl)Amino]-4-Keto-3-[[4-[(4-Methoxyphenyl)Amino]-3-Sulfonato-Phenyl]Hydrazono]Naphthalene-2,7-Disulfonate
• Molecular Formula: C₂₆H₁₆Cl₂N₇Na₃O₁₁S₃
• Molecular Weight: 838.51
• CAS Registry Number: 73398-42-2
• EINECS: 277-440-7
• SMILES: C2=C([S]([O-])(=O)=O)C=C(NC1=NC(=NC(=N1)Cl)Cl)C5=C2C=C([S]([O-])(=O)=O)/C(=N/NC4=CC(=C(NC3=CC=C(OC)C=C3)C=C4)[S]([O-])(=O)=O)C5=O.[Na+].[Na+].[Na+]
• InChI: 1S/C26H19Cl2N7O11S3.3Na/c1-46-15-5-2-13(3-6-15)29-17-7-4-14(10-19(17)48(40,41)42)34-35-22-20(49(43,44)45)9-12-8-16(47(37,38)39)11-18(21(12)23(22)36)30-26-32-24(27)31-25(28)33-26;;;/h2-11,29,34H,1H3,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,30,31,32,33);;;/q;3*+1/p-3/b35-22-
• InChIKey: HQAFOEUTURGHBA-BNVNWPCDSA-K