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Substance Name: Propanoic acid, 3-(4-((3-oxo-2(3H)-benzofuranylidene)methyl)phenoxy)-
RN: 70170-82-0
InChIKey: WNOYDIPXWGKRFY-LFIBNONCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H14-O5

Molecular Weight

  • 310.3036
 
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Names and Synonyms

Synonym

  • 3-(4-((3-Oxo-2(3H)-benzofuranylidene)methyl)phenoxy)propanoic acid

Systematic Name

  • Propanoic acid, 3-(4-((3-oxo-2(3H)-benzofuranylidene)methyl)phenoxy)-

Registry Numbers

CAS Registry Number

  • 70170-82-0

System Generated Number

  • 0070170820

Structure Descriptors

InChI

1S/C18H14O5/c19-17(20)9-10-22-13-7-5-12(6-8-13)11-16-18(21)14-3-1-2-4-15(14)23-16/h1-8,11H,9-10H2,(H,19,20)/b16-11+

InChIKey

WNOYDIPXWGKRFY-LFIBNONCSA-N

Smiles

c1ccc2c(c1)C(=O)/C(=C\c3ccc(cc3)OCCC(=O)O)/O2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2829619,