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Substance Name: Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester
RN: 78868-50-5
InChIKey: HODSKYOQIOFGMB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H17-N-O4

Molecular Weight

  • 323.3463
 
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Names and Synonyms

Synonyms

  • BRN 4530206
  • Methyl 4-(5-(4-methoxyphenyl)-3-isoxazolyl)benzeneacetate

Systematic Name

  • Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 78868-50-5

System Generated Number

  • 0078868505

Structure Descriptors

InChI

1S/C19H17NO4/c1-22-16-9-7-15(8-10-16)18-12-17(20-24-18)14-5-3-13(4-6-14)11-19(21)23-2/h3-10,12H,11H2,1-2H3

InChIKey

HODSKYOQIOFGMB-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)c2cc(no2)c3ccc(cc3)CC(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 20, Pg. 401, 1981.