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Substance Name: Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester
RN: 29002-34-4
InChIKey: JJPNFQMNRSINFS-VAWYXSNFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H13-N3-O6

Molecular Weight

  • 379.327
 
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Names and Synonyms

Synonyms

  • 2-Propenoic acid, 2-methyl-3-(2-nitrophenyl)-, 7-nitro-8-quinolinyl ester
  • alpha-Methyl-o-nitrocinnamic acid 7-nitro-8-quinolyl ester
  • BRN 1556153

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 29002-34-4

System Generated Number

  • 0029002344

Structure Descriptors

InChI

1S/C19H13N3O6/c1-12(11-14-5-2-3-7-15(14)21(24)25)19(23)28-18-16(22(26)27)9-8-13-6-4-10-20-17(13)18/h2-11H,1H3/b12-11+

InChIKey

JJPNFQMNRSINFS-VAWYXSNFSA-N

Smiles

c12c(c(ccc1cccn2)[N+](=O)[O-])OC(\C(=C\c1c(cccc1)[N+](=O)[O-])C)=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.