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Substance Name: Benzoic acid, 2-((((4-oxo-4H-1-benzopyran-2-yl)amino)carbonyl)amino)-, methyl ester
RN: 59629-56-0
InChIKey: LLNUUWSOIRQJEE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H14-N2-O5

Molecular Weight

  • 338.3176
 
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Names and Synonyms

Synonyms

  • 5-18-11-00419 (Beilstein Handbook Reference)
  • BRN 1663073
  • Methyl 2-((((4-oxo-4H-1-benzopyran-2-yl)amino)carbonyl)amino)benzoate

Systematic Name

  • Benzoic acid, 2-((((4-oxo-4H-1-benzopyran-2-yl)amino)carbonyl)amino)-, methyl ester

Registry Numbers

CAS Registry Number

  • 59629-56-0

System Generated Number

  • 0059629560

Structure Descriptors

InChI

1S/C18H14N2O5/c1-24-17(22)11-6-2-4-8-13(11)19-18(23)20-16-10-14(21)12-7-3-5-9-15(12)25-16/h2-10H,1H3,(H2,19,20,23)

InChIKey

LLNUUWSOIRQJEE-UHFFFAOYSA-N

Smiles

COC(=O)c1ccccc1NC(=O)Nc2cc(=O)c3ccccc3o2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1600mg/kg (1600mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 13, 1976.