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Substance Name: 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-
RN: 54903-27-4
InChIKey: XKJBWDLOEJBRTK-KBXRYBNXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H13-N-O3

Molecular Weight

  • 291.3047
 
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Names and Synonyms

Synonyms

  • 6-(1-Oxo-5-phenyl-2,4-pentadienyl)-2(3H)-benzoxazolone
  • BRN 1218031
  • JPB 57

Systematic Name

  • 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-

Registry Numbers

CAS Registry Number

  • 54903-27-4

System Generated Number

  • 0054903274

Structure Descriptors

InChI

1S/C18H13NO3/c20-16(9-5-4-8-13-6-2-1-3-7-13)14-10-11-15-17(12-14)22-18(21)19-15/h1-12H,(H,19,21)/b8-4+,9-5+

InChIKey

XKJBWDLOEJBRTK-KBXRYBNXSA-N

Smiles

c1ccc(cc1)/C=C/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.