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Substance Name: 5-Benzoxazoleacetic acid, 2-(4-chlorophenyl)-alpha-methyl-, ethyl ester
RN: 51234-41-4
InChIKey: MUAYIAAIKPJCDG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H16-Cl-N-O3

Molecular Weight

  • 329.781
 
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Names and Synonyms

Synonyms

  • BRN 1020036
  • Ethyl 2-(4-chlorophenyl)-alpha-methyl-5-benzoxazoleacetate

Systematic Name

  • 5-Benzoxazoleacetic acid, 2-(4-chlorophenyl)-alpha-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 51234-41-4

System Generated Number

  • 0051234414

Structure Descriptors

InChI

1S/C18H16ClNO3/c1-3-22-18(21)11(2)13-6-9-16-15(10-13)20-17(23-16)12-4-7-14(19)8-5-12/h4-11H,3H2,1-2H3

InChIKey

MUAYIAAIKPJCDG-UHFFFAOYSA-N

Smiles

c12c(oc(n1)c1ccc(Cl)cc1)ccc(c2)[C@@H](C(OCC)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1600mg/kg (1600mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 53, 1975.