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Substance Name: N-Desmethyltoremifene
RN: 110503-61-2
UNII: 2EBS4A61GK
InChIKey: WKJKBQYEFAFHCY-IZHYLOQSSA-N

Note

  • Metabolite of toremifene.

Molecular Formula

  • C25-H26-Cl-N-O

Molecular Weight

  • 391.939
 
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Names and Synonyms

Name of Substance

  • N-Desmethyltoremifene

Synonyms

  • 2-(4-((1Z)-4-Chloro-1,2-diphenyl-1-butenyl)phenoxy)-N-methylethanamine
  • N-Demethyltoremifene
  • N-Desmethyltoremifene
  • UNII-2EBS4A61GK

Systematic Name

  • Ethanamine, 2-(4-(4-chloro-1,2-diphenyl-1-butenyl)phenoxy)-N-methyl-, (Z)-

Registry Numbers

CAS Registry Number

  • 110503-61-2

FDA UNII

  • 2EBS4A61GK

System Generated Number

  • 0110503612

Structure Descriptors

InChI

1S/C25H26ClNO/c1-27-18-19-28-23-14-12-22(13-15-23)25(21-10-6-3-7-11-21)24(16-17-26)20-8-4-2-5-9-20/h2-15,27H,16-19H2,1H3/b25-24-

InChIKey

WKJKBQYEFAFHCY-IZHYLOQSSA-N

Smiles

c1cc(OCCNC)ccc1\C(=C(\CCCl)c1ccccc1)c1ccccc1