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Substance Name: Acetic acid, 2,2'-((4,4'-bis(2-(1-hydroxy-6-((4-methoxyphenyl)amino)-3-sulfo-2-naphthalenyl)diazenyl)(1,1'-biphenyl)-3,3'-diyl)bis(oxy))bis-, sodium salt (1:4)
RN: 6655-95-4
InChIKey: VOKDSCNEKOORBR-VPTDVZIBSA-J

Molecular Formula

  • C50-H40-N6-O16-S2.4Na

Molecular Weight

  • 1132.95
 
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Names and Synonyms

Synonym

  • EINECS 229-683-5

Systematic Names

  • Acetic acid, 2,2'-((4,4'-bis((1-hydroxy-6-((4-methoxyphenyl)amino)-3-sulfo-2-naphthalenyl)azo)(1,1'-biphenyl)-3,3'-diyl)bis(oxy))bis-, tetrasodium salt
  • Acetic acid, 2,2'-((4,4'-bis(2-(1-hydroxy-6-((4-methoxyphenyl)amino)-3-sulfo-2-naphthalenyl)diazenyl)(1,1'-biphenyl)-3,3'-diyl)bis(oxy))bis-, sodium salt (1:4)
  • Tetrasodium 2,2'-((4,4'-bis((1-hydroxy-6-((4-methoxyphenyl)amino)-3-sulphonato-2-naphthyl)azo)(1,1'-biphenyl)-3,3'-diyl)bis(oxy))diacetate

Registry Numbers

CAS Registry Number

  • 6655-95-4

System Generated Number

  • 0006655954

Molecular Formulas

Molecular Formula

  • C50-H40-N6-O16-S2.4Na

Molecular Formula Fragments

  • C50-H40-N6-O16-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C50H40N6O16S2.4Na/c1-69-35-11-5-31(6-12-35)51-33-9-15-37-29(19-33)23-43(73(63,64)65)47(49(37)61)55-53-39-17-3-27(21-41(39)71-25-45(57)58)28-4-18-40(42(22-28)72-26-46(59)60)54-56-48-44(74(66,67)68)24-30-20-34(10-16-38(30)50(48)62)52-32-7-13-36(70-2)14-8-32;;;;/h3-24,51-52,61-62H,25-26H2,1-2H3,(H,57,58)(H,59,60)(H,63,64,65)(H,66,67,68);;;;/q;4*+1/p-4/b55-53+,56-54+;;;;

InChIKey

VOKDSCNEKOORBR-VPTDVZIBSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].c1(cc(c(cc1)\N=N\c1c(c2ccc(cc2cc1S(=O)(=O)[O-])Nc1ccc(cc1)OC)O)OCC(=O)[O-])c1cc(c(cc1)\N=N\c1c(c2ccc(cc2cc1S(=O)(=O)[O-])Nc1ccc(cc1)OC)O)OCC(=O)[O-]