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Substance Name: 2(3H)-Benzoxazolone, 6-(3-(4-methoxyphenyl)-1-oxo-2-propenyl)-
RN: 54903-23-0
InChIKey: CLXFTNRFNACNSF-RUDMXATFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H13-N-O4

Molecular Weight

  • 295.2927
 
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Names and Synonyms

Synonyms

  • 6-(3-(4-Methoxyphenyl)-1-oxo-2-propenyl)-2(3H)-benzoxazolone
  • BRN 1003428
  • JPB 53

Systematic Name

  • 2(3H)-Benzoxazolone, 6-(3-(4-methoxyphenyl)-1-oxo-2-propenyl)-

Registry Numbers

CAS Registry Number

  • 54903-23-0

System Generated Number

  • 0054903230

Structure Descriptors

InChI

1S/C17H13NO4/c1-21-13-6-2-11(3-7-13)4-9-15(19)12-5-8-14-16(10-12)22-17(20)18-14/h2-10H,1H3,(H,18,20)/b9-4+

InChIKey

CLXFTNRFNACNSF-RUDMXATFSA-N

Smiles

COc1ccc(cc1)/C=C/C(=O)c2ccc3c(c2)oc(=O)[nH]3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2500mg/kg (2500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 497, 1974.