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Substance Name: 1,3-Benzodioxole-5-carboxylic acid, 6-((1,3-dihydro-3-oxo-1-isobenzofuranyl)amino)-
RN: 64179-32-4
InChIKey: YGMLWQILEBBPDQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H11-N-O6

Molecular Weight

  • 313.2639
 
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Names and Synonyms

Synonym

  • 6-((1,3-Dihydro-3-oxo-1-isobenzofuranyl)amino)-1,3-benzodioxole-5-carboxylic acid

Systematic Name

  • 1,3-Benzodioxole-5-carboxylic acid, 6-((1,3-dihydro-3-oxo-1-isobenzofuranyl)amino)-

Registry Numbers

CAS Registry Number

  • 64179-32-4

System Generated Number

  • 0064179324

Structure Descriptors

InChI

1S/C16H11NO6/c18-15(19)10-5-12-13(22-7-21-12)6-11(10)17-14-8-3-1-2-4-9(8)16(20)23-14/h1-6,14,17H,7H2,(H,18,19)

InChIKey

YGMLWQILEBBPDQ-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)C(OC2=O)Nc3cc4c(cc3C(=O)O)OCO4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #4122202,