Trisodium 5-Amino-3-[[4'-[(7-Amino-1-Hydroxy-3-Sulphonato-2-Naphthyl)Azo]-3,3'-Dimethyl[1,1'-Biphenyl]-4-Yl]Azo]-4-Hydroxynaphthalene-2,7-Disulphonate
[CAS# 66214-51-5]

Identification

• Name: Trisodium 5-Amino-3-[[4'-[(7-Amino-1-Hydroxy-3-Sulphonato-2-Naphthyl)Azo]-3,3'-Dimethyl[1,1'-Biphenyl]-4-Yl]Azo]-4-Hydroxynaphthalene-2,7-Disulphonate
• Synonyms: Trisodium (3E)-5-Amino-3-[[4-[4-[(N'z)-N'-(7-Amino-1-Oxo-3-Sulfonato-2-Naphthylidene)Hydrazino]-3-Methyl-Phenyl]-2-Methyl-Phenyl]Hydrazono]-4-Oxo-Naphthalene-2,7-Disulfonate; Trisodium (3E)-5-Amino-3-[[4-[4-[(N'z)-N'-(7-Amino-1-Oxo-3-Sulfonato-2-Naphthylidene)Hydrazino]-3-Methylphenyl]-2-Methylphenyl]Hydrazono]-4-Oxonaphthalene-2,7-Disulfonate; Trisodium (3E)-5-Amino-3-[[4-[4-[(N'z)-N'-(7-Amino-1-Keto-3-Sulfonato-2-Naphthylidene)Hydrazino]-3-Methyl-Phenyl]-2-Methyl-Phenyl]Hydrazono]-4-Keto-Naphthalene-2,7-Disulfonate
• Molecular Formula: C₃₄H₂₅N₆Na₃O₁₁S₃
• Molecular Weight: 858.75
• CAS Registry Number: 66214-51-5
• EINECS: 266-251-5
• SMILES: C1=C([S]([O-])(=O)=O)C=C(N)C6=C1C=C([S]([O-])(=O)=O)/C(=N/NC5=C(C=C(C4=CC(=C(N\N=C2/C(=CC3=C(C2=O)C=C(N)C=C3)[S]([O-])(=O)=O)C=C4)C)C=C5)C)C6=O.[Na+].[Na+].[Na+]
• InChI: 1S/C34H28N6O11S3.3Na/c1-16-9-18(4-7-26(16)37-39-31-28(53(46,47)48)12-20-3-6-22(35)14-24(20)33(31)41)19-5-8-27(17(2)10-19)38-40-32-29(54(49,50)51)13-21-11-23(52(43,44)45)15-25(36)30(21)34(32)42;;;/h3-15,37-38H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51);;;/q;3*+1/p-3/b39-31+,40-32-
• InChIKey: ZFYCZIRXEGXDQF-GRQZSQLOSA-K