3-[(Dimethylcarbamoyl)oxy]-5-isopropyl-N,N,N,2-tetramethylanilinium iodide

ChemSpider ID: 41881
Molecular Formula: C₁₆H₂₇IN₂O₂
Average mass: 406.302307 Da
Monoisotopic mass: 406.111725 Da
Systematic name

3-[(Dimethylcarbamoyl)oxy]-5-isopropyl-N,N,N,2-tetramethylanilinium iodide
SMILES and InChIs

SMILES:

[I-].O=C(Oc1cc(cc(c1C)[N+](C)(C)C)C(C)C)N(C)C Copied

Std. InChI:

InChI=1S/C16H27N2O2.HI/c1-11(2)13-9-14(18(6,7)8)12(3)15(10-13)20-16(19)17(4)5;/h9-11H,1-8H3;1H/q+1;/p-1 Copied

Std. InChIKey:

OWBMIRJXYXGPCS-UHFFFAOYSA-M Copied
Cite this record
CSID:41881, http://www.chemspider.com/Chemical-Structure.41881.html (accessed 02:27, Jun 20, 2013) Copied

Names and Identifiers

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

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