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Substance Name: 4-Acetamido-5-((4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)anthranilic acid, sodium salt
RN: 94158-82-4
InChIKey: VPIIHWNBJJJYOB-LLIZZRELSA-L

Molecular Formula

  • C16-H18-N4-O10-S3.x-Na

Molecular Weight

  • 566.4984
 
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Names and Synonyms

Synonym

  • EINECS 303-156-0

Systematic Names

  • 4-Acetamido-5-((4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)anthranilic acid, sodium salt
  • Benzenesulfonic acid, 4-(acetylamino)-2-amino-5-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-, sodium salt

Registry Numbers

CAS Registry Number

  • 94158-82-4

System Generated Number

  • 0094158824

Molecular Formulas

Molecular Formula

  • C16-H18-N4-O10-S3.x-Na

Molecular Formula Fragments

  • C16-H18-N4-O10-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H18N4O10S3.2Na/c1-10(21)18-14-8-13(17)16(32(24,25)26)9-15(14)20-19-11-2-4-12(5-3-11)31(22,23)7-6-30-33(27,28)29;;/h2-5,8-9H,6-7,17H2,1H3,(H,18,21)(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b20-19+;;

InChIKey

VPIIHWNBJJJYOB-LLIZZRELSA-L

Smiles

S(=O)(=O)(c1cc(c(cc1N)NC(=O)C)/N=N/c1ccc(S(=O)(=O)CCOS(=O)(=O)[O-])cc1)[O-].[Na+].[Na+]