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Substance Name: Acetic acid, (4-bromo-2-(((3-(trifluoromethyl)phenyl)amino)carbonyl)phenoxy)-
RN: 35508-59-9
InChIKey: GPPQNUYNLQIZDV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H11-Br-F3-N-O4

Molecular Weight

  • 418.164
 
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Names and Synonyms

Synonym

  • (4-Bromo-2-(((3-(trifluoromethyl)phenyl)amino)carbonyl)phenoxy)acetic acid

Systematic Name

  • Acetic acid, (4-bromo-2-(((3-(trifluoromethyl)phenyl)amino)carbonyl)phenoxy)-

Registry Numbers

CAS Registry Number

  • 35508-59-9

System Generated Number

  • 0035508599

Structure Descriptors

InChI

1S/C16H11BrF3NO4/c17-10-4-5-13(25-8-14(22)23)12(7-10)15(24)21-11-3-1-2-9(6-11)16(18,19)20/h1-7H,8H2,(H,21,24)(H,22,23)

InChIKey

GPPQNUYNLQIZDV-UHFFFAOYSA-N

Smiles

C(COc1c(cc(cc1)Br)C(=O)Nc1cc(ccc1)C(F)(F)F)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 23, Pg. 857, 1971.