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Substance Name: Trisodium 4-hydroxy-3-((4-methoxy-2-sulphonatophenyl)azo)-6-(methyl((2-(sulphonatooxy)ethyl)sulphonyl)amino)naphthalene-2-sulphonate
RN: 97692-54-1
InChIKey: MXLJSURIDCQDOU-ZRUFZDNISA-K

Molecular Formula

  • C20-H21-N3-O14-S4.3Na

Molecular Weight

  • 721.6032
 
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Names and Synonyms

Synonym

  • EINECS 307-706-0

Systematic Name

  • Trisodium 4-hydroxy-3-((4-methoxy-2-sulphonatophenyl)azo)-6-(methyl((2-(sulphonatooxy)ethyl)sulphonyl)amino)naphthalene-2-sulphonate

Registry Numbers

CAS Registry Number

  • 97692-54-1

System Generated Number

  • 0097692541

Molecular Formulas

Molecular Formula

  • C20-H21-N3-O14-S4.3Na

Molecular Formula Fragments

  • C20-H21-N3-O14-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H21N3O14S4.3Na/c1-23(38(25,26)8-7-37-41(33,34)35)13-4-3-12-9-18(40(30,31)32)19(20(24)15(12)10-13)22-21-16-6-5-14(36-2)11-17(16)39(27,28)29;;;/h3-6,9-11,24H,7-8H2,1-2H3,(H,27,28,29)(H,30,31,32)(H,33,34,35);;;/q;3*+1/p-3/b22-21+;;;

InChIKey

MXLJSURIDCQDOU-ZRUFZDNISA-K

Smiles

c1(S(=O)(=O)[O-])c(/N=N/c2c(S(=O)(=O)[O-])cc(cc2)OC)c(c2cc(N(S(=O)(=O)CCOS(=O)(=O)[O-])C)ccc2c1)O.[Na+].[Na+].[Na+]