ethyl 3-[1-(3-iodanylprop-2-ynyl)piperidin-1-ium-1-yl]propanoate

Systemtic Name: ethyl 3-[1-(3-iodanylprop-2-ynyl)piperidin-1-ium-1-yl]propanoate Openeye Name: ethyl 3-[1-(3-iodoprop-2-ynyl)piperidin-1-ium-1-yl]propanoate CAS Name: 3-[1-(3-iodoprop-2-ynyl)-1-piperidin-1-iumyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(3-iodoprop-2-ynyl)piperidin-1-ium-1-yl]propanoate Traditional Name: 3-[1-(3-iodoprop-2-ynyl)piperidin-1-ium-1-yl]propionic acid ethyl ester Formula: C13H21INO2+ MolecularWeight: 350.21581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC[N+]1(CCCCC1)CC#CI

Isomeric SMILES

CCOC(=O)CC[N+]1(CCCCC1)CC#CI

InChI

InChI=1S/C13H21INO2/c1-2-17-13(16)7-12-15(11-6-8-14)9-4-3-5-10-15/h2-5,7,9-12H2,1H3/q+1