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Substance Name: EINECS 277-347-1
RN: 73287-47-5
InChIKey: GHHPANBEVMYGMA-GZEJJAMTSA-G

Molecular Formula

  • C38-H20-Cu2-N5-O13-S3.3Na

Molecular Weight

  • 1046.86
 
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Names and Synonyms

Results Name

  • EINECS 277-347-1

Synonym

  • EINECS 277-347-1

Systematic Names

  • Cuprate(3-), (mu-(3-((3,3'-di(hydroxy-kappaO)-4'-((1-(hydroxy-kappaO)-6-(phenylamino)-3-sulfo-2-naphthalenyl)azo-kappaN1)(1,1'-biphenyl)-4-yl)azo-kappaN1)-4-(hydroxy-kappaO)-1,5-naphthalenedisulfonato(7-)))di-, trisodium
  • Cuprate(3-), (mu-(3-(2-(3,3'-di(hydroxy-kappaO)-4'-(2-(1-(hydroxy-kappaO)-6-(phenylamino)-3-sulfo-2-naphthalenyl)diazenyl-kappaN1)(1,1'-biphenyl)-4-yl)diazenyl-kappaN1)-4-(hydroxy-kappaO)-1,5-naphthalenedisulfonato(7-)))di-, sodium (1:3)
  • Trisodium (mu-(3-((4'-((6-anilino-1-hydroxy-3-sulpho-2-naphthyl)azo)-3,3'-dihydroxy(1,1'-biphenyl)-4-yl)azo)-4-hydroxynaphthalene-1,5-disulphonato(7-)))dicuprate(3-)

Registry Numbers

CAS Registry Number

  • 73287-47-5

System Generated Number

  • 0073287475

Molecular Formulas

Molecular Formula

  • C38-H20-Cu2-N5-O13-S3.3Na

Molecular Formula Fragments

  • C38-H20-Cu2-N5-O13-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H27N5O13S3.2Cu.3Na/c44-30-16-20(9-13-27(30)40-42-29-19-33(58(51,52)53)26-7-4-8-32(57(48,49)50)35(26)38(29)47)21-10-14-28(31(45)17-21)41-43-36-34(59(54,55)56)18-22-15-24(11-12-25(22)37(36)46)39-23-5-2-1-3-6-23;;;;;/h1-19,39,44-47H,(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;;/q;2*+2;3*+1/p-7/b42-40+,43-41+;;;;;

InChIKey

GHHPANBEVMYGMA-GZEJJAMTSA-G

Smiles

c1(cc(c(c2c1cccc2S([O-])(=O)=O)[O-])\N=N\c1ccc(cc1[O-])c1cc([O-])c(\N=N\c2c(S([O-])(=O)=O)cc3c(c2[O-])ccc(Nc2ccccc2)c3)cc1)S(=O)(=O)[O-].[Cu+2].[Cu+2].[Na+].[Na+].[Na+]