Trisodium 3-[(2-Chloro-4-Nitrophenyl)Azo]-5-[[2,4-Dihydroxy-5-[[4-[(4-Nitro-2-Sulphonatophenyl)Amino]Phenyl]Azo]Phenyl]Azo]-4-Hydroxynaphthalene-2,7-Disulphonate
[CAS# 85391-42-0]

Identification

• Name: Trisodium 3-[(2-Chloro-4-Nitrophenyl)Azo]-5-[[2,4-Dihydroxy-5-[[4-[(4-Nitro-2-Sulphonatophenyl)Amino]Phenyl]Azo]Phenyl]Azo]-4-Hydroxynaphthalene-2,7-Disulphonate
• Synonyms: Trisodium (3E)-3-[(2-Chloro-4-Nitro-Phenyl)Hydrazono]-5-[[(3Z)-6-Hydroxy-3-[[4-[(4-Nitro-2-Sulfonato-Phenyl)Amino]Phenyl]Hydrazono]-4-Oxo-1-Cyclohexa-1,5-Dienyl]Azo]-4-Oxo-Naphthalene-2,7-Disulfonate; Trisodium (3E)-3-[(2-Chloro-4-Nitrophenyl)Hydrazono]-5-[[(3Z)-6-Hydroxy-3-[[4-[(4-Nitro-2-Sulfonatophenyl)Amino]Phenyl]Hydrazono]-4-Oxo-1-Cyclohexa-1,5-Dienyl]Azo]-4-Oxonaphthalene-2,7-Disulfonate; Trisodium (3E)-3-[(2-Chloro-4-Nitro-Phenyl)Hydrazono]-5-[[(3Z)-6-Hydroxy-4-Keto-3-[[4-[(4-Nitro-2-Sulfonato-Phenyl)Amino]Phenyl]Hydrazono]-1-Cyclohexa-1,5-Dienyl]Azo]-4-Keto-Naphthalene-2,7-Disulfonate
• Molecular Formula: C₃₄H₁₉ClN₉Na₃O₁₆S₃
• Molecular Weight: 1010.18
• CAS Registry Number: 85391-42-0
• EINECS: 286-796-2
• SMILES: C4=C([S]([O-])(=O)=O)C=C(N=NC3=CC(=N/NC2=CC=C(NC1=C([S]([O-])(=O)=O)C=C([N+]([O-])=O)C=C1)C=C2)/C(=O)C=C3O)C6=C4C=C([S]([O-])(=O)=O)/C(=N/NC5=C(Cl)C=C([N+]([O-])=O)C=C5)C6=O.[Na+].[Na+].[Na+]
• InChI: 1S/C34H22ClN9O16S3.3Na/c35-22-11-19(43(48)49)5-7-23(22)38-42-33-31(63(58,59)60)10-16-9-21(61(52,53)54)13-27(32(16)34(33)47)41-40-26-14-25(28(45)15-29(26)46)39-37-18-3-1-17(2-4-18)36-24-8-6-20(44(50)51)12-30(24)62(55,56)57;;;/h1-15,36-38,46H,(H,52,53,54)(H,55,56,57)(H,58,59,60);;;/q;3*+1/p-3/b39-25-,41-40?,42-33-
• InChIKey: CWJXXUGGVYPEPF-QPAMBTLESA-K