Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-methyl-4-(piperidinomethyl)-, hydrochloride
RN: 96401-68-2
InChIKey: HXVSRHFBERGWGN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N-O2.Cl-H

Molecular Weight

  • 309.835
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 3,4-Dihydro-7-methyl-4-(1-piperidinomethyl)-1-benzoxepin-5(2H)-one hydrochloride

Systematic Names

  • 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-methyl-4-(1-piperidinylmethyl)-, hydrochloride
  • 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-methyl-4-(piperidinomethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 96401-68-2

System Generated Number

  • 0096401682

Molecular Formulas

Molecular Formula

  • C17-H23-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H23-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H23NO2.ClH/c1-13-5-6-16-15(11-13)17(19)14(7-10-20-16)12-18-8-3-2-4-9-18;/h5-6,11,14H,2-4,7-10,12H2,1H3;1H

InChIKey

HXVSRHFBERGWGN-UHFFFAOYSA-N

Smiles

c12c(ccc(c2)C)OCC[C@@H](C1=O)C[NH+]1CCCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 24, Pg. 71, 1985.