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Substance Name: Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-(phenylamino)-6-((4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, sodium salt (1:4)
RN: 34233-64-2
InChIKey: TZFWNQCIWOFPJO-MOSUJMLHSA-L

Molecular Formula

  • C44-H36-N12-O12-S4.4Na

Molecular Weight

  • 1143.05
 
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Names and Synonyms

Synonym

  • EINECS 251-892-5

Systematic Names

  • Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-(phenylamino)-6-((4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, sodium salt (1:4)
  • Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-(phenylamino)-6-((4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, tetrasodium salt
  • Tetrasodium 4,4'-bis((4-anilino-6-(p-sulphonatoanilino)-1,3,5-triazin-2-yl)amino)stilbene-2,2'-disulphonate

Registry Numbers

CAS Registry Number

  • 34233-64-2

Other Registry Number

  • 84593-72-6

System Generated Number

  • 0034233642

Molecular Formulas

Molecular Formula

  • C44-H36-N12-O12-S4.4Na

Molecular Formula Fragments

  • C44-H36-N12-O12-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C44H36N12O12S4.4Na/c57-69(58,59)35-21-17-31(18-22-35)47-41-51-39(45-29-7-3-1-4-8-29)53-43(55-41)49-33-15-13-27(37(25-33)71(63,64)65)11-12-28-14-16-34(26-38(28)72(66,67)68)50-44-54-40(46-30-9-5-2-6-10-30)52-42(56-44)48-32-19-23-36(24-20-32)70(60,61)62;;;;/h1-26H,(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68)(H3,45,47,49,51,53,55)(H3,46,48,50,52,54,56);;;;/q;4*+1/p-2/b12-11+;;;;

InChIKey

TZFWNQCIWOFPJO-MOSUJMLHSA-L

Smiles

S(c1cc(Nc2nc(Nc3ccc(cc3)S(=O)(=O)O)nc(n2)Nc2ccccc2)ccc1\C=C\c1c(cc(Nc2nc(Nc3ccccc3)nc(Nc3ccc(cc3)S(=O)(=O)[O-])n2)cc1)S(=O)(=O)[O-])(=O)(=O)O.[Na+].[Na+].[Na+].[Na+]