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Substance Name: Disodium 5-chloro-2-(4-chloro-1-(sulphonatooxy)-2-naphthyl)-7-methoxy-4-methyl-1H-indol-3-yl sulphate
RN: 4086-05-9
InChIKey: KIJRNJKWJKPKAT-UHFFFAOYSA-L

Molecular Formula

  • C20-H15-Cl2-N-O9-S2.2Na

Molecular Weight

  • 592.3387
 
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Names and Synonyms

Synonym

  • EINECS 223-815-5

Systematic Name

  • Disodium 5-chloro-2-(4-chloro-1-(sulphonatooxy)-2-naphthyl)-7-methoxy-4-methyl-1H-indol-3-yl sulphate

Registry Numbers

CAS Registry Number

  • 4086-05-9

System Generated Number

  • 0004086059

Molecular Formulas

Molecular Formula

  • C20-H15-Cl2-N-O9-S2.2Na

Molecular Formula Fragments

  • C20-H15-Cl2-N-O9-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H15Cl2NO9S2.2Na/c1-9-13(21)8-15(30-2)18-16(9)20(32-34(27,28)29)17(23-18)12-7-14(22)10-5-3-4-6-11(10)19(12)31-33(24,25)26;;/h3-8,23H,1-2H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2

InChIKey

KIJRNJKWJKPKAT-UHFFFAOYSA-L

Smiles

S(=O)(=O)(Oc1c([nH]c2c1c(c(cc2OC)Cl)C)c1c(c2c(cccc2)c(c1)Cl)OS(=O)(=O)[O-])[O-].[Na+].[Na+]