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Substance Name: 3,3'-(Carbonyldiimino)bis(4-methoxy-6-nitrobenzenesulphonic) acid,sodium salt
RN: 84787-96-2
InChIKey: HCUBAUITYFKGGF-UHFFFAOYSA-N

Molecular Formula

  • C15-H14-N4-O13-S2.x-Na

Molecular Weight

  • 545.4126
 
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Names and Synonyms

Synonym

  • EINECS 284-135-2

Systematic Name

  • 3,3'-(Carbonyldiimino)bis(4-methoxy-6-nitrobenzenesulphonic) acid,sodium salt

Registry Numbers

CAS Registry Number

  • 84787-96-2

System Generated Number

  • 0084787962

Molecular Formulas

Molecular Formula

  • C15-H14-N4-O13-S2.x-Na

Molecular Formula Fragments

  • C15-H14-N4-O13-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C15H14N4O13S2.Na/c1-31-11-5-9(18(21)22)13(33(25,26)27)3-7(11)16-15(20)17-8-4-14(34(28,29)30)10(19(23)24)6-12(8)32-2;/h3-6H,1-2H3,(H2,16,17,20)(H,25,26,27)(H,28,29,30);/q;+1

InChIKey

HCUBAUITYFKGGF-UHFFFAOYSA-N

Smiles

[Na+].COc1cc(c(cc1NC(=O)Nc2cc(c(cc2OC)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]