Sodium hydrogen 5-({4'-[(8-amino-1-hydroxy-3,6-disulfonato-2-naphthyl)diazenyl]-3,3'-dimethoxy-4-biphenylyl}diazenyl)-2-hydroxybenzoate (2:1:1)
[CAS# 93964-58-0]

Identification

• Name: Sodium hydrogen 5-({4'-[(8-amino-1-hydroxy-3,6-disulfonato-2-naphthyl)diazenyl]-3,3'-dimethoxy-4-biphenylyl}diazenyl)-2-hydroxybenzoate (2:1:1)
• Synonyms: disodium hydrogen 5-[[4'-[(8-amino-1-hydroxy-3,6-disulphonato-2-naphthyl)azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]salicylate
• Molecular Formula: C₃₁H₂₃N₅Na₂O₁₂S₂
• Molecular Weight: 767.65
• CAS Registry Number: 93964-58-0
• EINECS: 300-904-8
• SMILES: [H+].[Na+].[Na+].COc3cc(ccc3N=Nc2c(cc1cc(cc(N)c1c2O)S([O-])(=O)=O)S([O-])(=O)=O)c5ccc(N=Nc4cc(C([O-])=O)c(O)cc4)c(OC)c5
• InChI: 1S/C31H25N5O12S2.2Na/c1-47-25-10-15(3-6-22(25)34-33-18-5-8-24(37)20(13-18)31(39)40)16-4-7-23(26(11-16)48-2)35-36-29-27(50(44,45)46)12-17-9-19(49(41,42)43)14-21(32)28(17)30(29)38;;/h3-14,37-38H,32H2,1-2H3,(H,39,40)(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2
• InChIKey: MTHZRBOSKSDRHC-UHFFFAOYSA-L