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Substance Name: Furo(2,3-c)pyridin-2(4H)-one, 5,6,7,7a-tetrahydro-6,7a-dimethyl-5-(4-methoxyphenyl)-, methanesulfonate
RN: 107885-50-7
InChIKey: ZQHSBJJVKIRBNG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-N-O3.C-H4-O3-S

Molecular Weight

  • 369.4357
 
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Names and Synonyms

  • Furo(2,3-c)pyridin-2(4H)-one, 5,6,7,7a-tetrahydro-6,7a-dimethyl-5-(4-methoxyphenyl)-, methanesulfonate

Registry Numbers

CAS Registry Number

  • 107885-50-7

System Generated Number

  • 0107885507

Molecular Formulas

Molecular Formula

  • C16-H19-N-O3.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C16-H19-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C16H19NO3.CH4O3S/c1-16-10-17(2)14(8-12(16)9-15(18)20-16)11-4-6-13(19-3)7-5-11;1-5(2,3)4/h4-7,9,14H,8,10H2,1-3H3;1H3,(H,2,3,4)

InChIKey

ZQHSBJJVKIRBNG-UHFFFAOYSA-N

Smiles

CC12CN(C(CC1=CC(=O)O2)c3ccc(cc3)OC)C.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 812mg/kg (812mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 841, 1986.