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Substance Name: Indomethacin ethyl ester
RN: 16401-99-3
InChIKey: COIRSVPTDJIIKY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H20-Cl-N-O4

Molecular Weight

  • 385.845
 
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Names and Synonyms

Results Name

  • Indomethacin ethyl ester

Synonyms

  • 1-(p-Chlorobenzoyl)-5-methoxy-2-methyl-3-indoleacetic acid ethyl ester
  • 5-22-05-00240 (Beilstein Handbook Reference)
  • BRN 0497742
  • Indomethacin ethyl ester

Systematic Names

  • 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, ethyl ester (9CI)
  • Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 16401-99-3

System Generated Number

  • 0016401993

Structure Descriptors

InChI

1S/C21H20ClNO4/c1-4-27-20(24)12-17-13(2)23(19-10-9-16(26-3)11-18(17)19)21(25)14-5-7-15(22)8-6-14/h5-11H,4,12H2,1-3H3

InChIKey

COIRSVPTDJIIKY-UHFFFAOYSA-N

Smiles

CCOC(=O)Cc1c(n(c2c1cc(cc2)OC)C(=O)c3ccc(cc3)Cl)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 40mg/kg (40mg/kg)   Bollettino Chimico Farmaceutico. Vol. 114, Pg. 309, 1975.