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Substance Name: Benzoic acid, 4-(1,1-dimethylethyl)-, 7-nitro-8-quinolinyl ester
RN: 29007-25-8
InChIKey: PUXRCNPDZCNYOX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H18-N2-O4

Molecular Weight

  • 350.372
 
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Names and Synonyms

Synonyms

  • 8-Quinolinol, 7-nitro-, 4-(1,1-dimethylethyl)benzoate
  • BRN 1551477

Systematic Name

  • Benzoic acid, 4-(1,1-dimethylethyl)-, 7-nitro-8-quinolinyl ester

Registry Numbers

CAS Registry Number

  • 29007-25-8

System Generated Number

  • 0029007258

Structure Descriptors

InChI

1S/C20H18N2O4/c1-20(2,3)15-9-6-14(7-10-15)19(23)26-18-16(22(24)25)11-8-13-5-4-12-21-17(13)18/h4-12H,1-3H3

InChIKey

PUXRCNPDZCNYOX-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)C(C)(C)C)(=O)Oc1c(ccc2cccnc12)[N+](=O)[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. 767, 1973.