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Substance Name: Benzeneacetic acid, alpha-methyl-4-(5-phenyl-3-isoxazolyl)-
RN: 78868-43-6
InChIKey: GULYBHMZVBSTKE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H15-N-O3

Molecular Weight

  • 293.3205
 
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Names and Synonyms

Synonyms

  • alpha-Methyl-4-(5-phenyl-3-isoxazolyl)benzeneacetic acid
  • BRN 4502722

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 78868-43-6

System Generated Number

  • 0078868436

Structure Descriptors

InChI

1S/C18H15NO3/c1-12(18(20)21)13-7-9-14(10-8-13)16-11-17(22-19-16)15-5-3-2-4-6-15/h2-12H,1H3,(H,20,21)

InChIKey

GULYBHMZVBSTKE-UHFFFAOYSA-N

Smiles

CC(c1ccc(cc1)c2cc(on2)c3ccccc3)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 584mg/kg (584mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 20, Pg. 401, 1981.