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Substance Name: Benzoic acid, 3,5-dimethoxy-, 7-nitro-8-quinolyl ester
RN: 29007-62-3
InChIKey: NLBFZBFNANIREN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H18-N2-O6

Molecular Weight

  • 354.3166
 
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Names and Synonyms

Synonyms

  • 3,5-Dimethoxybenzoic acid, 7-nitro-8-quinolyl ester
  • 8-Quinolinol, 7-nitro-, 3,5-dimethoxybenzoate

Systematic Name

  • Benzoic acid, 3,5-dimethoxy-, 7-nitro-8-quinolyl ester

Registry Numbers

CAS Registry Number

  • 29007-62-3

System Generated Number

  • 0029007623

Structure Descriptors

InChI

1S/C18H14N2O6/c1-24-13-8-12(9-14(10-13)25-2)18(21)26-17-15(20(22)23)6-5-11-4-3-7-19-16(11)17/h3-10H,1-2H3

InChIKey

NLBFZBFNANIREN-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1)OC)C(=O)Oc2c(ccc3c2nccc3)[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.