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Substance Name: Benzeneacetic acid, 4-(5-phenyl-3-isoxazolyl)-
RN: 78868-39-0
InChIKey: RJJMUXRJFCPHJL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H13-N-O3

Molecular Weight

  • 279.2937
 
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Names and Synonyms

Synonyms

  • 4-(5-Phenyl-3-isoxazolyl)benzeneacetic acid
  • BRN 4484122

Systematic Name

  • Benzeneacetic acid, 4-(5-phenyl-3-isoxazolyl)-

Registry Numbers

CAS Registry Number

  • 78868-39-0

System Generated Number

  • 0078868390

Structure Descriptors

InChI

1S/C17H13NO3/c19-17(20)10-12-6-8-13(9-7-12)15-11-16(21-18-15)14-4-2-1-3-5-14/h1-9,11H,10H2,(H,19,20)

InChIKey

RJJMUXRJFCPHJL-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2cc(no2)c3ccc(cc3)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 923mg/kg (923mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 20, Pg. 401, 1981.