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Substance Name: 8-Quinolinol, 7-nitro-, p-nitrobenzoate (ester)
RN: 29007-14-5
InChIKey: OKIYTJMQXQZXDM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H9-N3-O6

Molecular Weight

  • 339.262
 
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Names and Synonyms

Synonyms

  • 5-21-03-00299 (Beilstein Handbook Reference)
  • 7-Nitro-8-quinolinol p-nitrobenzoate (ester)
  • Benzoic acid, p-nitro-, 7-nitro-8-quinolyl ester
  • BRN 1553617

Systematic Name

  • 8-Quinolinol, 7-nitro-, p-nitrobenzoate (ester)

Registry Numbers

CAS Registry Number

  • 29007-14-5

System Generated Number

  • 0029007145

Structure Descriptors

InChI

1S/C16H9N3O6/c20-16(11-3-6-12(7-4-11)18(21)22)25-15-13(19(23)24)8-5-10-2-1-9-17-14(10)15/h1-9H

InChIKey

OKIYTJMQXQZXDM-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)[N+](=O)[O-])(=O)Oc1c(ccc2cccnc12)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2700mg/kg (2700mg/kg)   Bollettino Chimico Farmaceutico. Vol. 112, Pg. 767, 1973.