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Substance Name: 1H-Pyrrole-3-acetic acid, 2,5-dimethyl-1-(4-ethoxyphenyl)-
RN: 42780-01-8
InChIKey: WFOHOJNXYZKFEU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-N-O3

Molecular Weight

  • 273.33
 
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Names and Synonyms

Synonyms

  • 2,5-Dimethyl-1-(4-ethoxyphenyl)-1H-pyrrole-3-acetic acid
  • BRN 0418501

Systematic Name

  • 1H-Pyrrole-3-acetic acid, 2,5-dimethyl-1-(4-ethoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 42780-01-8

System Generated Number

  • 0042780018

Structure Descriptors

InChI

1S/C16H19NO3/c1-4-20-15-7-5-14(6-8-15)17-11(2)9-13(12(17)3)10-16(18)19/h5-9H,4,10H2,1-3H3,(H,18,19)

InChIKey

WFOHOJNXYZKFEU-UHFFFAOYSA-N

Smiles

n1(c(c(cc1C)CC(=O)O)C)c1ccc(cc1)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1230mg/kg (1230mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.
mouse LD50 oral 1230mg/kg (1230mg/kg) BEHAVIORAL: ANALGESIA European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.