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Substance Name: 1(2H)-Pyridineacetic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 1,1-dimethylethyl ester, monohydrochloride, (E)-
RN: 139886-15-0
InChIKey: YGKDPXXNMXEPGF-XHIXCECLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H22-N2-O3.Cl-H

Molecular Weight

  • 290.7887
 
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Names and Synonyms

Synonym

  • 1,1-Dimethylethyl 3,6-dihydro-5-((methoxyimino)methyl)-1(2H)-pyridineacetate

Systematic Name

  • 1(2H)-Pyridineacetic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 1,1-dimethylethyl ester, monohydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 139886-15-0

System Generated Number

  • 0139886150

Molecular Formulas

Molecular Formula

  • C13-H22-N2-O3.Cl-H

Molecular Formula Fragments

  • C13-H22-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H22N2O3.ClH/c1-13(2,3)18-12(16)10-15-7-5-6-11(9-15)8-14-17-4;/h6,8H,5,7,9-10H2,1-4H3;1H/b14-8+;

InChIKey

YGKDPXXNMXEPGF-XHIXCECLSA-N

Smiles

CC(C)(C)OC(=O)CN1CCC=C(C1)/C=N/OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 400mg/kg (400mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 853, 1991.