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Substance Name: Furo(2,3-c)pyridin-2(4H)-one, 5,6,7,7a-tetrahydro-6,7a-dimethyl-5-phenyl-, methanesulfonate
RN: 107885-48-3
InChIKey: AFDILTIIQUQRNE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-N-O2.C-H4-O3-S

Molecular Weight

  • 339.4099
 
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Names and Synonyms

Synonym

  • 5,6,7,7a-Tetrahydro-6,7a-dimethyl-5-phenylfuro(2,3-c)pyridin-2(4H)-one methanesulfonate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 107885-48-3

System Generated Number

  • 0107885483

Molecular Formulas

Molecular Formula

  • C15-H17-N-O2.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C15-H17-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C15H17NO2.CH4O3S/c1-15-10-16(2)13(11-6-4-3-5-7-11)8-12(15)9-14(17)18-15;1-5(2,3)4/h3-7,9,13H,8,10H2,1-2H3;1H3,(H,2,3,4)

InChIKey

AFDILTIIQUQRNE-UHFFFAOYSA-N

Smiles

CC12CN(C(CC1=CC(=O)O2)c3ccccc3)C.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 678mg/kg (678mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 20, Pg. 1461, 1986.