3-Iodo-4-(1-piperidinylmethyl)benzoic acid

ChemSpider ID: 23960145
Molecular Formula: C₁₃H₁₆INO₂
Average mass: 345.176086 Da
Monoisotopic mass: 345.022552 Da
Systematic name

3-Iodo-4-(1-piperidinylmethyl)benzoic acid
SMILES and InChIs

SMILES:

c1cc(c(cc1C(=O)O)I)CN2CCCCC2 Copied

Std. InChI:

InChI=1S/C13H16INO2/c14-12-8-10(13(16)17)4-5-11(12)9-15-6-2-1-3-7-15/h4-5,8H,1-3,6-7,9H2,(H,16,17) Copied

Std. InChIKey:

ZYPGVRYZSLQUJP-UHFFFAOYSA-N Copied
Cite this record
CSID:23960145, http://www.chemspider.com/Chemical-Structure.23960145.html (accessed 01:08, May 22, 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