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Substance Name: 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-((methoxyamino)carbonyl)-4-(3-nitrophenyl)-, methyl ester
RN: 133147-06-5
InChIKey: BJVAKXDQHCRCSN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N3-O6

Molecular Weight

  • 361.3521
 
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Names and Synonyms

Synonym

  • BRN 4272918

Systematic Name

  • 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-((methoxyamino)carbonyl)-4-(3-nitrophenyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 133147-06-5

System Generated Number

  • 0133147065

Structure Descriptors

InChI

1S/C17H19N3O6/c1-9-13(16(21)19-26-4)15(14(10(2)18-9)17(22)25-3)11-6-5-7-12(8-11)20(23)24/h5-8,15,18H,1-4H3,(H,19,21)

InChIKey

BJVAKXDQHCRCSN-UHFFFAOYSA-N

Smiles

CC1=C(C(C(=C(N1)C)C(=O)OC)c2cccc(c2)[N+](=O)[O-])C(=O)NOC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 400mg/kg (400mg/kg)   Farmaco. Vol. 45, Pg. 1327, 1990.
mouse LD50 intravenous > 180mg/kg (180mg/kg)   Farmaco. Vol. 45, Pg. 1327, 1990.
mouse LD50 oral > 2gm/kg (2000mg/kg)   Farmaco. Vol. 45, Pg. 1327, 1990.