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Substance Name: 1H-Indol-3-ol, 2-(9-chloro-3-(sulfooxy)naphtho(1,2-b)thien-2-yl)-, 3-(hydrogen sulfate), sodium salt (1:2)
RN: 10169-52-5
InChIKey: VQNHJDZRCIAIHS-UHFFFAOYSA-L

Molecular Formula

  • C20-H12-Cl-N-O8-S3.2Na

Molecular Weight

  • 569.929
 
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Names and Synonyms

Synonym

  • EINECS 233-441-4

Systematic Names

  • 1H-Indol-3-ol, 2-(9-chloro-3-(sulfooxy)naphtho(1,2-b)thien-2-yl)-, 3-(hydrogen sulfate), sodium salt (1:2)
  • 1H-Indol-3-ol, 2-(9-chloro-3-(sulfooxy)naphtho(1,2-b)thien-2-yl)-, hydrogen sulfate (ester), disodium salt
  • Disodium 2-(9-chloro-3-(sulphonatooxy)naphtho(1,2-b)thien-2-yl)-1H-indol-3-yl sulphate

Registry Numbers

CAS Registry Number

  • 10169-52-5

System Generated Number

  • 0010169525

Molecular Formulas

Molecular Formula

  • C20-H12-Cl-N-O8-S3.2Na

Molecular Formula Fragments

  • C20-H12-Cl-N-O8-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H12ClNO8S3.2Na/c21-13-6-3-4-10-8-9-12-18(30-33(26,27)28)20(31-19(12)15(10)13)16-17(29-32(23,24)25)11-5-1-2-7-14(11)22-16;;/h1-9,22H,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2

InChIKey

VQNHJDZRCIAIHS-UHFFFAOYSA-L

Smiles

c12c3sc(c4c(OS(=O)(=O)[O-])c5ccccc5[nH]4)c(OS(=O)(=O)[O-])c3ccc1cccc2Cl.[Na+].[Na+]