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Substance Name: 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 4-nitrophenyl ester, (E)-
RN: 145071-47-2
InChIKey: XBEILLPHWGCCKO-OQLLNIDSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H15-N3-O5

Molecular Weight

  • 305.2885
 
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Names and Synonyms

Synonyms

  • 4-Nitrophenyl (E)-3,6-dihydro-5-((methoxyimino)methyl)-1(2H)-pyridinecarboxylate
  • BRN 5827710

Systematic Name

  • 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 4-nitrophenyl ester, (E)-

Registry Numbers

CAS Registry Number

  • 145071-47-2

System Generated Number

  • 0145071472

Structure Descriptors

InChI

1S/C14H15N3O5/c1-21-15-9-11-3-2-8-16(10-11)14(18)22-13-6-4-12(5-7-13)17(19)20/h3-7,9H,2,8,10H2,1H3/b15-9+

InChIKey

XBEILLPHWGCCKO-OQLLNIDSSA-N

Smiles

CO/N=C/C1=CCCN(C1)C(=O)Oc2ccc(cc2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 519, 1992.