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Substance Name: Sodium 2-((5-cyano-2,6-bis((3-methoxypropyl)amino)-4-methyl-3-pyridyl)azo)-5-nitrobenzenesulphonate
RN: 84962-47-0
InChIKey: UPXRUNLIBXFYIL-JGUILPGDSA-M

Molecular Formula

  • C21-H27-N7-O7-S.Na

Molecular Weight

  • 543.5344
 
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Names and Synonyms

Synonym

  • EINECS 284-744-3

Systematic Name

  • Sodium 2-((5-cyano-2,6-bis((3-methoxypropyl)amino)-4-methyl-3-pyridyl)azo)-5-nitrobenzenesulphonate

Registry Numbers

CAS Registry Number

  • 84962-47-0

System Generated Number

  • 0084962470

Molecular Formulas

Molecular Formula

  • C21-H27-N7-O7-S.Na

Molecular Formula Fragments

  • C21-H27-N7-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H27N7O7S.Na/c1-14-16(13-22)20(23-8-4-10-34-2)25-21(24-9-5-11-35-3)19(14)27-26-17-7-6-15(28(29)30)12-18(17)36(31,32)33;/h6-7,12H,4-5,8-11H2,1-3H3,(H2,23,24,25)(H,31,32,33);/q;+1/p-1/b27-26+;

InChIKey

UPXRUNLIBXFYIL-JGUILPGDSA-M

Smiles

Cc1c(c(nc(c1/N=N/c2ccc(cc2S(=O)(=O)[O-])[N+](=O)[O-])NCCCOC)NCCCOC)C#N.[Na+]