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Substance Name: Hexanoic acid, 6-(6-chloro-4-oxo-4H-1-benzopyran-2-carboxamido)-
RN: 27455-40-9
InChIKey: WVKSJNZDEOKELM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H16-Cl-N-O5

Molecular Weight

  • 337.757
 
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Names and Synonyms

Synonyms

  • 5-18-08-00317 (Beilstein Handbook Reference)
  • 6-(6-Chloro-4-oxo-4H-1-benzopyran-2-carboxamido)hexanoic acid
  • BRN 1398777

Systematic Name

  • Hexanoic acid, 6-(6-chloro-4-oxo-4H-1-benzopyran-2-carboxamido)-

Registry Numbers

CAS Registry Number

  • 27455-40-9

System Generated Number

  • 0027455409

Structure Descriptors

InChI

1S/C16H16ClNO5/c17-10-5-6-13-11(8-10)15(21)12(9-23-13)16(22)18-7-3-1-2-4-14(19)20/h5-6,8-9H,1-4,7H2,(H,18,22)(H,19,20)

InChIKey

WVKSJNZDEOKELM-UHFFFAOYSA-N

Smiles

c12c(occ(c1=O)C(NCCCCCC(O)=O)=O)ccc(c2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   Annales Pharmaceutiques Francaises. Vol. 31, Pg. 313, 1973.