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Substance Name: Resobene
RN: 164416-13-1
InChIKey: GPNLPYGUGHPGKX-YJJRJLFPSA-J

Molecular Formula

  • C28-H20-N4-O14-S2.4Na

Molecular Weight

  • 788.54
 
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Names and Synonyms

Name of Substance

  • Resobene

Synonym

  • 4,4'-Bis(2-carboxy-4,6-dihydroxyphenylazo)stilbene-2,2'-disulfonic acid tetrasodium salt

Systematic Names

  • Benzoic acid, 2,2'-((1E)-1,2-ethenediylbis((1E)-(3-sulfo-4,1-phenylene)azo))bis(3,5-dihydroxy-, tetrasodium salt
  • Benzoic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)azo))bis(3,5-dihydroxy-, tetrasodium salt, (E,E,E)-

Registry Numbers

CAS Registry Number

  • 164416-13-1

System Generated Number

  • 0164416131

Molecular Formulas

Molecular Formula

  • C28-H20-N4-O14-S2.4Na

Molecular Formula Fragments

  • C28-H20-N4-O14-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C28H20N4O14S2.4Na/c33-17-9-19(27(37)38)25(21(35)11-17)31-29-15-5-3-13(23(7-15)47(41,42)43)1-2-14-4-6-16(8-24(14)48(44,45)46)30-32-26-20(28(39)40)10-18(34)12-22(26)36;;;;/h1-12,33-36H,(H,37,38)(H,39,40)(H,41,42,43)(H,44,45,46);;;;/q;4*+1/p-4/b2-1+,31-29+,32-30+;;;;

InChIKey

GPNLPYGUGHPGKX-YJJRJLFPSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].S([O-])(=O)(=O)c1cc(\N=N\c2c(cc(O)cc2C([O-])=O)O)ccc1\C=C\c1c(cc(cc1)\N=N\c1c(cc(cc1O)O)C(=O)[O-])S(=O)(=O)[O-]