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Substance Name: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-(5-nitro-2-furanyl)ethenyl)-, diethyl ester
RN: 71160-14-0
InChIKey: BWEBLEKOSPXVIT-VQHVLOKHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N2-O7

Molecular Weight

  • 390.3898
 
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Names and Synonyms

Synonym

  • BRN 1181069

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-(5-nitro-2-furanyl)ethenyl)-, diethyl ester

Registry Numbers

CAS Registry Number

  • 71160-14-0

System Generated Number

  • 0071160140

Structure Descriptors

InChI

1S/C19H22N2O7/c1-5-26-18(22)16-11(3)20-12(4)17(19(23)27-6-2)14(16)9-7-13-8-10-15(28-13)21(24)25/h7-10,14,20H,5-6H2,1-4H3/b9-7+

InChIKey

BWEBLEKOSPXVIT-VQHVLOKHSA-N

Smiles

CCOC(=O)C1=C(NC(=C(C1/C=C/c2ccc(o2)[N+](=O)[O-])C(=O)OCC)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 9gm/kg (9000mg/kg)   Pharmaceutical Chemistry Journal Vol. 13, Pg. 611, 1979.