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Substance Name: 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester
RN: 133147-10-1
InChIKey: BIIFWRNNQIQZJJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N3-O7

Molecular Weight

  • 419.4315
 
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Names and Synonyms

Synonym

  • BRN 4276990

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 133147-10-1

System Generated Number

  • 0133147101

Structure Descriptors

InChI

1S/C20H25N3O7/c1-5-29-9-10-30-22-19(24)16-12(2)21-13(3)17(20(25)28-4)18(16)14-7-6-8-15(11-14)23(26)27/h6-8,11,18,21H,5,9-10H2,1-4H3,(H,22,24)

InChIKey

BIIFWRNNQIQZJJ-UHFFFAOYSA-N

Smiles

CCOCCONC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Farmaco. Vol. 45, Pg. 1327, 1990.
mouse LD50 intravenous > 210mg/kg (210mg/kg)   Farmaco. Vol. 45, Pg. 1327, 1990.
mouse LD50 oral > 1500mg/kg (1500mg/kg)   Farmaco. Vol. 45, Pg. 1327, 1990.