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Substance Name: Cinnamic acid, p-chloro-, 7-nitro-8-quinolyl ester
RN: 29002-19-5
InChIKey: VDTURHFTBLAJTK-BJMVGYQFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H11-Cl-N2-O4

Molecular Weight

  • 354.748
 
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Names and Synonyms

Synonyms

  • 2-Propenoic acid, 3-(4-chlorophenyl)-, 7-nitro-8-quinolinyl ester
  • BRN 1550026
  • p-Chlorocinnamic acid 7-nitro-8-quinolyl ester

Systematic Name

  • Cinnamic acid, p-chloro-, 7-nitro-8-quinolyl ester

Registry Numbers

CAS Registry Number

  • 29002-19-5

System Generated Number

  • 0029002195

Structure Descriptors

InChI

1S/C18H11ClN2O4/c19-14-7-3-12(4-8-14)5-10-16(22)25-18-15(21(23)24)9-6-13-2-1-11-20-17(13)18/h1-11H/b10-5+

InChIKey

VDTURHFTBLAJTK-BJMVGYQFSA-N

Smiles

c12c(c(ccc1cccn2)[N+](=O)[O-])OC(\C=C\c1ccc(Cl)cc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3gm/kg (3000mg/kg)   Bollettino Chimico Farmaceutico. Vol. 112, Pg. 776, 1973.