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Substance Name: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-(5-nitro-2-furanyl)ethenyl)-, dimethyl ester
RN: 71160-15-1
InChIKey: XDFZEFNGTBHXCX-FNORWQNLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-N2-O7

Molecular Weight

  • 362.3362
 
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Names and Synonyms

Synonym

  • BRN 1173945

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 71160-15-1

System Generated Number

  • 0071160151

Structure Descriptors

InChI

1S/C17H18N2O7/c1-9-14(16(20)24-3)12(15(10(2)18-9)17(21)25-4)7-5-11-6-8-13(26-11)19(22)23/h5-8,12,18H,1-4H3/b7-5+

InChIKey

XDFZEFNGTBHXCX-FNORWQNLSA-N

Smiles

CC1=C(C(C(=C(N1)C)C(=O)OC)/C=C/c2ccc(o2)[N+](=O)[O-])C(=O)OC

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.