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Substance Name: EINECS 286-204-2
RN: 85188-14-3
InChIKey: GRURKBXRKWHRPA-CBVUHXOASA-H

Molecular Formula

  • C58-H50-N10-O22-S6.6Na

Molecular Weight

  • 1563.3696
 
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Names and Synonyms

Results Name

  • EINECS 286-204-2

Synonym

  • EINECS 286-204-2

Systematic Name

  • Hexasodium 3,3'-azobis(6-(2-(4-((2-methoxy-4-((4-methoxy-3-sulphonatophenyl)azo)-5-methylphenyl)azo)-2-sulphonatophenyl)vinyl)benzenesulphonate)

Registry Numbers

CAS Registry Number

  • 85188-14-3

System Generated Number

  • 0085188143

Molecular Formulas

Molecular Formula

  • C58-H50-N10-O22-S6.6Na

Molecular Formula Fragments

  • C58-H50-N10-O22-S6
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C58H50N10O22S6.6Na/c1-33-23-47(51(89-5)31-45(33)65-61-43-19-21-49(87-3)57(29-43)95(81,82)83)67-63-41-17-13-37(55(27-41)93(75,76)77)9-7-35-11-15-39(25-53(35)91(69,70)71)59-60-40-16-12-36(54(26-40)92(72,73)74)8-10-38-14-18-42(28-56(38)94(78,79)80)64-68-48-24-34(2)46(32-52(48)90-6)66-62-44-20-22-50(88-4)58(30-44)96(84,85)86;;;;;;/h7-32H,1-6H3,(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)(H,81,82,83)(H,84,85,86);;;;;;/q;6*+1/p-6/b9-7+,10-8+,60-59+,65-61+,66-62+,67-63+,68-64+;;;;;;

InChIKey

GRURKBXRKWHRPA-CBVUHXOASA-H

Smiles

Cc1c(cc(c(c1)/N=N/c2cc(c(cc2)/C=C/c3c(cc(cc3)/N=N/c4cc(c(cc4)/C=C/c5c(cc(cc5)/N=N/c6c(cc(c(c6)C)/N=N/c7cc(c(cc7)OC)S(=O)(=O)[O-])OC)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC)/N=N/c8cc(c(cc8)OC)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]