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Substance Name: Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-((2-hydroxyethyl)methylamino)-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, sodium salt (1:4)
RN: 68413-51-4
InChIKey: RZQYLDRJOVNEAS-GWIKJDHCSA-J

Molecular Formula

  • C38-H40-N12-O14-S4.4Na

Molecular Weight

  • 1104.9964
 
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Names and Synonyms

Synonyms

  • 2,2'-Stilbenedisulfonic acid, 4,4'-bis((4-((2-hydroxyethyl)methylamino)-6-(m-sulfoanilino)-s-triazin-2-yl)amino)-, tetrasodium salt
  • EINECS 270-223-8

Systematic Names

  • Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-((2-hydroxyethyl)methylamino)-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, sodium salt (1:4)
  • Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-((2-hydroxyethyl)methylamino)-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-, tetrasodium salt
  • Tetrasodium 4,4'-bis((4-((2-hydroxyethyl)methylamino)-6-((3-sulphonatophenyl)amino)-1,3,5-triazin-2-yl)amino)stilbene-2,2'-disulphonate

Registry Numbers

CAS Registry Number

  • 68413-51-4

System Generated Number

  • 0068413514

Molecular Formulas

Molecular Formula

  • C38-H40-N12-O14-S4.4Na

Molecular Formula Fragments

  • C38-H40-N12-O14-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H40N12O14S4.4Na/c1-49(15-17-51)37-45-33(39-25-5-3-7-29(19-25)65(53,54)55)43-35(47-37)41-27-13-11-23(31(21-27)67(59,60)61)9-10-24-12-14-28(22-32(24)68(62,63)64)42-36-44-34(46-38(48-36)50(2)16-18-52)40-26-6-4-8-30(20-26)66(56,57)58;;;;/h3-14,19-22,51-52H,15-18H2,1-2H3,(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64)(H2,39,41,43,45,47)(H2,40,42,44,46,48);;;;/q;4*+1/p-4/b10-9+;;;;

InChIKey

RZQYLDRJOVNEAS-GWIKJDHCSA-J

Smiles

CN(CCO)c1nc(nc(n1)Nc2ccc(c(c2)S(=O)(=O)[O-])/C=C/c3ccc(cc3S(=O)(=O)[O-])Nc4nc(nc(n4)N(C)CCO)Nc5cccc(c5)S(=O)(=O)[O-])Nc6cccc(c6)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]