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Substance Name: Benzoic acid, 3,4,5-trimethoxy-, 2-(1H-1,2,4-triazol-1-yl)ethyl ester
RN: 66760-21-2
InChIKey: YNEMAUAUYCTKBH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H17-N3-O5

Molecular Weight

  • 307.3043
 
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Names and Synonyms

Synonyms

  • 2-(1H-1,2,4-Triazol-1-yl)ethyl 3,4,5-trimethoxybenzoate
  • BRN 0571566
  • Trimethoxy-3,4,5 benzoate d'(hydroxy-2 ethyl)-1 triazole-1,2,4

Systematic Name

  • Benzoic acid, 3,4,5-trimethoxy-, 2-(1H-1,2,4-triazol-1-yl)ethyl ester

Registry Numbers

CAS Registry Number

  • 66760-21-2

System Generated Number

  • 0066760212

Structure Descriptors

InChI

1S/C14H17N3O5/c1-19-11-6-10(7-12(20-2)13(11)21-3)14(18)22-5-4-17-9-15-8-16-17/h6-9H,4-5H2,1-3H3

InChIKey

YNEMAUAUYCTKBH-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1OC)OC)C(=O)OCCn2cncn2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 300mg/kg (300mg/kg)   Annales Pharmaceutiques Francaises. Vol. 35, Pg. 503, 1977.