Trisodium 5-(Acetylamino)-4-Hydroxy-3-[[2-Methoxy-5-Methyl-4-[(4-Nitro-2-Sulphonatophenyl)Azo]Phenyl]Azo]Naphthalene-2,7-Disulphonate
[CAS# 84583-92-6]

Identification

• Name: Trisodium 5-(Acetylamino)-4-Hydroxy-3-[[2-Methoxy-5-Methyl-4-[(4-Nitro-2-Sulphonatophenyl)Azo]Phenyl]Azo]Naphthalene-2,7-Disulphonate
• Synonyms: Trisodium (3E)-5-Acetamido-3-[[2-Methoxy-5-Methyl-4-(4-Nitro-2-Sulfonato-Phenyl)Azo-Phenyl]Hydrazono]-4-Oxo-Naphthalene-2,7-Disulfonate; Trisodium (3E)-5-Acetamido-3-[[2-Methoxy-5-Methyl-4-(4-Nitro-2-Sulfonatophenyl)Azophenyl]Hydrazono]-4-Oxonaphthalene-2,7-Disulfonate; Trisodium (3E)-5-Acetamido-4-Keto-3-[[2-Methoxy-5-Methyl-4-(4-Nitro-2-Sulfonato-Phenyl)Azo-Phenyl]Hydrazono]Naphthalene-2,7-Disulfonate
• Molecular Formula: C₂₆H₁₉N₆Na₃O₁₄S₃
• Molecular Weight: 804.62
• CAS Registry Number: 84583-92-6
• EINECS: 283-245-8
• SMILES: C1=C([S]([O-])(=O)=O)C=C(NC(=O)C)C4=C1C=C([S]([O-])(=O)=O)/C(=N/NC3=C(OC)C=C(N=NC2=C([S]([O-])(=O)=O)C=C([N+]([O-])=O)C=C2)C(=C3)C)C4=O.[Na+].[Na+].[Na+]
• InChI: 1S/C26H22N6O14S3.3Na/c1-12-6-19(21(46-3)11-18(12)29-28-17-5-4-15(32(35)36)9-22(17)48(40,41)42)30-31-25-23(49(43,44)45)8-14-7-16(47(37,38)39)10-20(27-13(2)33)24(14)26(25)34;;;/h4-11,30H,1-3H3,(H,27,33)(H,37,38,39)(H,40,41,42)(H,43,44,45);;;/q;3*+1/p-3/b29-28?,31-25-
• InChIKey: WQMJIBLUCVZJMJ-IVQCLYLRSA-K