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Substance Name: Cinnamic acid, p-chloro-alpha-methyl-, 7-nitro-8-quinolyl ester
RN: 29002-31-1
InChIKey: BPGBWJRROFHIMC-VAWYXSNFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H13-Cl-N2-O4

Molecular Weight

  • 368.775
 
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Names and Synonyms

Synonyms

  • 2-Propenoic acid, 3-(4-chlorophenyl)-2-methyl-, 7-nitro-8-quinolinyl ester
  • BRN 1552613
  • p-Chloro-alpha-methylcinnamic acid 7-nitro-8-quinolyl ester

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 29002-31-1

System Generated Number

  • 0029002311

Structure Descriptors

InChI

1S/C19H13ClN2O4/c1-12(11-13-4-7-15(20)8-5-13)19(23)26-18-16(22(24)25)9-6-14-3-2-10-21-17(14)18/h2-11H,1H3/b12-11+

InChIKey

BPGBWJRROFHIMC-VAWYXSNFSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1800mg/kg (1800mg/kg)   Bollettino Chimico Farmaceutico. Vol. 112, Pg. 776, 1973.