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Substance Name: 1H-Indol-3-ol, 5,7-dichloro-2-(6-chloro-4-methyl-3-(sulfooxy)benzo(b)thien-2-yl)-, 3-(hydrogen sulfate), sodium salt (1:2)
RN: 10241-20-0
InChIKey: LLSDKKSSBUBKCC-UHFFFAOYSA-L

Molecular Formula

  • C17-H10-Cl3-N-O8-S3.2Na

Molecular Weight

  • 602.786
 
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Names and Synonyms

Synonym

  • EINECS 233-576-9

Systematic Names

  • 1H-Indol-3-ol, 5,7-dichloro-2-(6-chloro-4-methyl-3-(sulfooxy)benzo(b)thien-2-yl)-, 3-(hydrogen sulfate), sodium salt (1:2)
  • 1H-Indol-3-ol, 5,7-dichloro-2-(6-chloro-4-methyl-3-(sulfooxy)benzo(b)thien-2-yl)-, hydrogen sulfate (ester), disodium salt
  • Disodium 5,7-dichloro-2-(6-chloro-4-methyl-3-(sulphonatooxy)benzo(b)thien-2-yl)-1H-indol-3-yl sulphate

Registry Numbers

CAS Registry Number

  • 10241-20-0

System Generated Number

  • 0010241200

Molecular Formulas

Molecular Formula

  • C17-H10-Cl3-N-O8-S3.2Na

Molecular Formula Fragments

  • C17-H10-Cl3-N-O8-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C17H10Cl3NO8S3.2Na/c1-6-2-7(18)5-11-12(6)16(29-32(25,26)27)17(30-11)14-15(28-31(22,23)24)9-3-8(19)4-10(20)13(9)21-14;;/h2-5,21H,1H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2

InChIKey

LLSDKKSSBUBKCC-UHFFFAOYSA-L

Smiles

c12sc(c3c(OS(=O)(=O)[O-])c4cc(Cl)cc(c4[nH]3)Cl)c(OS(=O)(=O)[O-])c1c(C)cc(Cl)c2.[Na+].[Na+]