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Substance Name: 5-Hydroxyindomethacin
RN: 2504-32-7
InChIKey: KMLNWQPYFBIALN-UHFFFAOYSA-N

Note

  • Metabolite of indomethacin.

Molecular Formula

  • C18-H14-Cl-N-O4

Molecular Weight

  • 343.7646
 
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Names and Synonyms

Name of Substance

  • 5-Hydroxyindomethacin

Synonyms

  • 1-(p-Chlorobenzoyl)-5-hydroxy-2-methylindole-3-acetic acid
  • Demethylindomethacin
  • Desmethyl-indomethacin
  • Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-hydroxy-2-methyl-
  • O-Desmethylindomethacin

Systematic Name

  • 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-hydroxy-2-methyl-

Registry Numbers

CAS Registry Number

  • 2504-32-7

System Generated Number

  • 0002504327

Structure Descriptors

InChI

1S/C18H14ClNO4/c1-10-14(9-17(22)23)15-8-13(21)6-7-16(15)20(10)18(24)11-2-4-12(19)5-3-11/h2-8,21H,9H2,1H3,(H,22,23)

InChIKey

KMLNWQPYFBIALN-UHFFFAOYSA-N

Smiles

Cc1c(c2cc(ccc2n1C(=O)c3ccc(cc3)Cl)O)CC(=O)O