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Substance Name: Butanoic acid, 2-(phenylmethylene)-, 7-nitro-8-quinolinyl ester
RN: 29002-15-1
InChIKey: ZMXQHSVNMQOTDB-FYWRMAATSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H16-N2-O4

Molecular Weight

  • 348.356
 
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Names and Synonyms

Synonyms

  • 2-(Phenylmethylene)butanoic acid 7-nitro-8-quinolinyl ester
  • BRN 1552130

Systematic Name

  • Butanoic acid, 2-(phenylmethylene)-, 7-nitro-8-quinolinyl ester

Registry Numbers

CAS Registry Number

  • 29002-15-1

System Generated Number

  • 0029002151

Structure Descriptors

InChI

1S/C20H16N2O4/c1-2-15(13-14-7-4-3-5-8-14)20(23)26-19-17(22(24)25)11-10-16-9-6-12-21-18(16)19/h3-13H,2H2,1H3/b15-13+

InChIKey

ZMXQHSVNMQOTDB-FYWRMAATSA-N

Smiles

c12c(c(ccc1cccn2)[N+](=O)[O-])OC(\C(=C\c1ccccc1)CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 420mg/kg (420mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 1545, 1974.