Trisodium 5-nitro-2-[(E)-2-{2-sulfonato-4-[(E)-{4-[(4-sulfonatophenyl)diazenyl]phenyl}-azoxy]phenyl}vinyl]benzenesulfonate
[CAS# 39363-31-0]

Identification

• Name: Trisodium 5-nitro-2-[(E)-2-{2-sulfonato-4-[(E)-{4-[(4-sulfonatophenyl)diazenyl]phenyl}-azoxy]phenyl}vinyl]benzenesulfonate
• Synonyms: trisodium 2-[2-(4-nitro-2-sulphonatophenyl)vinyl]-5-[[4-[(4-sulphonatophenyl)azo]phenyl]-NNO-azoxy]benzenesulphonate
• Molecular Formula: C₂₆H₁₆N₅Na₃O₁₂S₃
• Molecular Weight: 755.60
• CAS Registry Number: 39363-31-0
• EINECS: 254-429-5
• SMILES: [Na+].[Na+].[Na+].[O-][N+](=O)c4ccc(/C=C/c1ccc(cc1S([O-])(=O)=O)[N+](\[O-])=N/c3ccc(N=Nc2ccc(cc2)S([O-])(=O)=O)cc3)c(c4)S([O-])(=O)=O
• InChI: 1S/C26H19N5O12S3.3Na/c32-30(29-21-7-5-19(6-8-21)27-28-20-9-13-24(14-10-20)44(35,36)37)22-11-3-17(25(15-22)45(38,39)40)1-2-18-4-12-23(31(33)34)16-26(18)46(41,42)43;;;/h1-16H,(H,35,36,37)(H,38,39,40)(H,41,42,43);;;/q;3*+1/p-3/b2-1+,28-27?,30-29+
• InChIKey: FPWJOCBLKPOSNT-XEQFVGIFSA-K