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Substance Name: Disodium 5-amino-9,10-dihydro-6-methyl-8-((4-methylsulphonatophenyl)amino)-9,10-dioxoanthracenesulphonate
RN: 83027-59-2
InChIKey: KWCMAYCHELZXLQ-UHFFFAOYSA-L

Molecular Formula

  • C22-H18-N2-O8-S2.2Na

Molecular Weight

  • 546.4864
 
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Names and Synonyms

Synonym

  • EINECS 280-161-3

Systematic Name

  • Disodium 5-amino-9,10-dihydro-6-methyl-8-((4-methylsulphonatophenyl)amino)-9,10-dioxoanthracenesulphonate

Registry Numbers

CAS Registry Number

  • 83027-59-2

System Generated Number

  • 0083027592

Molecular Formulas

Molecular Formula

  • C22-H18-N2-O8-S2.2Na

Molecular Formula Fragments

  • C22-H18-N2-O8-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C22H18N2O8S2.2Na/c1-10-6-7-13(16(8-10)34(30,31)32)24-14-9-11(2)20(23)19-18(14)22(26)17-12(21(19)25)4-3-5-15(17)33(27,28)29;;/h3-9,24H,23H2,1-2H3,(H,27,28,29)(H,30,31,32);;/q;2*+1/p-2

InChIKey

KWCMAYCHELZXLQ-UHFFFAOYSA-L

Smiles

Cc1ccc(c(c1)S(=O)(=O)[O-])Nc2cc(c(c3c2C(=O)c4c(cccc4S(=O)(=O)[O-])C3=O)N)C.[Na+].[Na+]