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Substance Name: 2-Naphthalenesulfonic acid, 3-(2-(4-ethoxy-3-sulfophenyl)diazenyl)-4-hydroxy-7-((((5-hydroxy-7-sulfo-6-(2-(6-sulfo-2-naphthalenyl)diazenyl)-2-naphthalenyl)amino)carbonyl)amino)-, compd. with 2,2'-(methylimino)bis(ethanol) (1:4)
RN: 73003-72-2
InChIKey: JWPQJBRIUWEJLH-QILDMFASSA-N

Molecular Formula

  • C39-H30-N6-O16-S4.4C5-H13-N-O2

Molecular Weight

  • 1443.6068
 
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Names and Synonyms

Synonym

  • 4-Hydroxy-7-((((5-hydroxy-6-((4-ethoxy-3-sulfophenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-((6-sulfo-2-naphthalenyl)azo)-2-naphthalenesulfonic acid, tetra(methyldiethanolamine) salt

Systematic Names

  • 2-Naphthalenesulfonic acid, 3-((4-ethoxy-3-sulfophenyl)azo)-4-hydroxy-7-((((5-hydroxy-7-sulfo-6-((6-sulfo-2-naphthalenyl)azo)-2-naphthalenyl)amino)carbonyl)amino)-, compd. with 2,2'-(methylimino)bis(ethanol) (1:4)
  • 2-Naphthalenesulfonic acid, 3-(2-(4-ethoxy-3-sulfophenyl)diazenyl)-4-hydroxy-7-((((5-hydroxy-7-sulfo-6-(2-(6-sulfo-2-naphthalenyl)diazenyl)-2-naphthalenyl)amino)carbonyl)amino)-, compd. with 2,2'-(methylimino)bis(ethanol) (1:4)

Registry Numbers

CAS Registry Number

  • 73003-72-2

System Generated Number

  • 0073003722

Molecular Formulas

Molecular Formula

  • C39-H30-N6-O16-S4.4C5-H13-N-O2

Molecular Formula Fragments

  • C39-H30-N6-O16-S4
  • C5-H13-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C39H30N6O16S4.4C5H13NO2/c1-2-61-31-12-8-27(19-32(31)63(52,53)54)43-45-36-34(65(58,59)60)18-23-15-25(7-11-30(23)38(36)47)41-39(48)40-24-6-10-29-22(14-24)17-33(64(55,56)57)35(37(29)46)44-42-26-5-3-21-16-28(62(49,50)51)9-4-20(21)13-26;4*1-6(2-4-7)3-5-8/h3-19,46-47H,2H2,1H3,(H2,40,41,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);4*7-8H,2-5H2,1H3/b44-42+,45-43+;;;;

InChIKey

JWPQJBRIUWEJLH-QILDMFASSA-N

Smiles

CCOc1ccc(cc1S(=O)(=O)O)/N=N/c2c(cc3cc(ccc3c2O)NC(=O)Nc4ccc5c(c4)cc(c(c5O)/N=N/c6ccc7cc(ccc7c6)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.CN(CCO)CCO.CN(CCO)CCO.CN(CCO)CCO.CN(CCO)CCO