Want to comment
on this record?

2-(7-Ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-N,N,N-trimethyl-2-oxoethanaminium iodide

ChemSpider ID: 3676149
Molecular Formula: C₁₅H₂₂INO₃
Average mass: 391.244598 Da
Monoisotopic mass: 391.064423 Da
Systematic name

2-(7-Ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-N,N,N-trimethyl-2-oxoethanaminium iodide
SMILES and InChIs

SMILES:

[I-].O=C(c2c(cc1OCCOc1c2)CC)C[N+](C)(C)C Copied

Std. InChI:

InChI=1S/C15H22NO3.HI/c1-5-11-8-14-15(19-7-6-18-14)9-12(11)13(17)10-16(2,3)4;/h8-9H,5-7,10H2,1-4H3;1H/q+1;/p-1 Copied

Std. InChIKey:

UVICSVOISYHQKT-UHFFFAOYSA-M Copied
Cite this record
CSID:3676149, http://www.chemspider.com/Chemical-Structure.3676149.html (accessed 07:04, May 19, 2013) Copied

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Click to predict properties on the Chemicalize site

Patents	Personal Collections
Publication or Magazine Article	Web-based Article (blog or commentary)
Available Chemicals Databases	Biological Properties
Chemical Reactions	Chemical Safety Data
Drugs or Compounds in Development	Imaging Agents
Information Aggregators	Journal Publishers via MeSH
Ligand/binding/crystal Structure Databases	Metabolic Pathways
Molecular Libraries Screening Center Network	Natural Products
NIH Substance Repository	Physical Properties (including SAR/QSAR databases)
Protein 3D Structures	Spectroscopy Databases
Substance Vendors	Theoretical Properties
Toxicology/Environmental Databases	Virtual Library