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Substance Name: 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-(2-(1-sulfo-6-((2-(sulfooxy)ethyl)sulfonyl)-2-naphthalenyl)diazenyl)-
RN: 68400-00-0
InChIKey: HIJJKUHQANBAOM-QNEJGDQOSA-N

Molecular Formula

  • C29-H23-N3-O17-S5

Molecular Weight

  • 845.8347
 
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Names and Synonyms

Synonym

  • EINECS 270-006-8

Systematic Names

  • 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-((1-sulfo-6-((2-(sulfooxy)ethyl)sulfonyl)-2-naphthalenyl)azo)-
  • 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-(2-(1-sulfo-6-((2-(sulfooxy)ethyl)sulfonyl)-2-naphthalenyl)diazenyl)-
  • 5-(Benzoylamino)-4-hydroxy-3-((1-sulpho-6-((2-(sulphooxy)ethyl)sulphonyl)-2-naphthyl)azo)naphthalene-2,7-disulphonic acid

Registry Numbers

CAS Registry Number

  • 68400-00-0

System Generated Number

  • 0068400000

Structure Descriptors

InChI

1S/C29H23N3O17S5/c33-27-25-18(13-20(51(37,38)39)15-23(25)30-29(34)16-4-2-1-3-5-16)14-24(52(40,41)42)26(27)32-31-22-9-6-17-12-19(7-8-21(17)28(22)53(43,44)45)50(35,36)11-10-49-54(46,47)48/h1-9,12-15,33H,10-11H2,(H,30,34)(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)/b32-31+

InChIKey

HIJJKUHQANBAOM-QNEJGDQOSA-N

Smiles

c1ccc(cc1)C(=O)Nc2cc(cc3c2c(c(c(c3)S(=O)(=O)O)/N=N/c4ccc5cc(ccc5c4S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O)O)S(=O)(=O)O