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Substance Name: EINECS 274-389-2
RN: 70209-90-4
InChIKey: GWUTVSJRONXQFI-RFQWQKRDSA-I

Molecular Formula

  • C48-H35-N9-O19-S4.5Na

Molecular Weight

  • 1280.02
 
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Names and Synonyms

Results Name

  • EINECS 274-389-2

Synonyms

  • Benzoic acid, 5-((3-(((4-((4-((8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-3-methoxy-7-sulfo-1-naphthalenyl)azo-3-sulfophenyl)amino)carbonyl)phenyl)azo)-2-hydroxy-, pentasodium salt
  • EINECS 274-389-2

Systematic Names

  • Benzoic acid, 5-((3-(((4-((4-((8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-3-methoxy-7-sulfo-1-naphthalenyl)azo)-3-sulfophenyl)amino)carbonyl)phenyl)azo)-2-hydroxy-, pentasodium salt
  • Benzoic acid, 5-(2-(3-(((4-(2-(4-(2-(8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-3-methoxy-7-sulfo-1-naphthalenyl)diazenyl)-3-sulfophenyl)amino)carbonyl)phenyl)diazenyl)-2-hydroxy-, sodium salt (1:5)
  • Pentasodium 5-((3-(((4-((4-((8-((3-aminobenzoyl)amino)-1-hydroxy-3,6-disulphonato-2-naphthyl)azo)-3-methoxy-7-sulphonato-1-naphthyl)azo)-3-sulphonatophenyl)amino)carbonyl)phenyl)azo)salicylate

Registry Numbers

CAS Registry Number

  • 70209-90-4

System Generated Number

  • 0070209904

Molecular Formulas

Molecular Formula

  • C48-H35-N9-O19-S4.5Na

Molecular Formula Fragments

  • C48-H35-N9-O19-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C48H35N9O19S4.5Na/c1-76-39-22-36(55-54-35-12-8-27(19-40(35)79(70,71)72)50-46(60)24-5-3-7-28(15-24)52-53-29-9-13-38(58)34(18-29)48(62)63)33-20-30(77(64,65)66)10-11-32(33)43(39)56-57-44-41(80(73,74)75)17-25-16-31(78(67,68)69)21-37(42(25)45(44)59)51-47(61)23-4-2-6-26(49)14-23;;;;;/h2-22,58-59H,49H2,1H3,(H,50,60)(H,51,61)(H,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)(H,73,74,75);;;;;/q;5*+1/p-5/b53-52+,55-54+,57-56+;;;;;

InChIKey

GWUTVSJRONXQFI-RFQWQKRDSA-I

Smiles

N(=N\c1c(cc(c2c1ccc(c2)S(=O)(=O)[O-])\N=N\c1c(cc(cc1)NC(=O)c1cc(ccc1)\N=N\c1ccc(c(c1)C([O-])=O)O)S(=O)(=O)[O-])OC)\c1c(c2c(cc1S(=O)(=O)[O-])cc(cc2NC(=O)c1cc(ccc1)N)S(=O)(=O)[O-])O.[Na+].[Na+].[Na+].[Na+].[Na+]