Sodium 1-[4-(Chloroacetamido)Phenyl] 2-[[2-Amino-6-[[Ethyl(4-Sulphonatophenyl)Amino]Sulphonyl]-8-Hydroxy-1-Naphthyl]Azo]Benzenesulphonate
[CAS# 90697-54-4]

Identification

• Name: Sodium 1-[4-(Chloroacetamido)Phenyl] 2-[[2-Amino-6-[[Ethyl(4-Sulphonatophenyl)Amino]Sulphonyl]-8-Hydroxy-1-Naphthyl]Azo]Benzenesulphonate
• Synonyms: Sodium 4-[[5-[N'-[2-[4-(Acetyl-Chloro-Amino)Phenoxy]Sulfonylphenyl]Hydrazino]-6-Imino-4-Oxo-2-Naphthyl]Sulfonyl-Ethyl-Amino]Benzenesulfonate; Sodium 4-[[5-[N'-[2-[4-(Acetyl-Chloroamino)Phenoxy]Sulfonylphenyl]Hydrazino]-6-Imino-4-Oxo-2-Naphthyl]Sulfonyl-Eth
• Molecular Formula: C₃₂H₂₇ClN₅NaO₁₀S₃
• Molecular Weight: 796.22
• CAS Registry Number: 90697-54-4
• EINECS: 292-675-5
• SMILES: C5=C(N([S](=O)(=O)C4=CC(=O)C3=C(NNC1=CC=CC=C1[S](OC2=CC=C(N(Cl)C(=O)C)C=C2)(=O)=O)C(=N)C=CC3=C4)CC)C=CC(=C5)[S]([O-])(=O)=O.[Na+]
• InChI: 1S/C32H28ClN5O10S3.Na/c1-3-37(22-11-15-25(16-12-22)50(43,44)45)49(41,42)26-18-21-8-17-27(34)32(31(21)29(40)19-26)36-35-28-6-4-5-7-30(28)51(46,47)48-24-13-9-23(10-14-24)38(33)20(2)39;/h4-19,34-36H,3H2,1-2H3,(H,43,44,45);/q;+1/p-1
• InChIKey: FXWBVJFGLKNSKN-UHFFFAOYSA-M