5-(2,6-dimethylpiperidin-1-ium-1-yl)pent-3-yn-2-ol chloride

Systemtic Name: 5-(2,6-dimethylpiperidin-1-ium-1-yl)pent-3-yn-2-ol chloride Openeye Name: 5-(2,6-dimethylpiperidin-1-ium-1-yl)pent-3-yn-2-ol chloride CAS Name: 5-(2,6-dimethyl-1-piperidin-1-iumyl)-3-pentyn-2-ol chloride IUPAC Name: 5-(2,6-dimethylpiperidin-1-ium-1-yl)pent-3-yn-2-ol chloride Traditional Name: 5-(2,6-dimethylpiperidin-1-ium-1-yl)pent-3-yn-2-ol chloride Formula: C12H22ClNO MolecularWeight: 231.76218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC#CC(C)O)C.[Cl-]

Isomeric SMILES

CC1CCCC([NH+]1CC#CC(C)O)C.[Cl-]

InChI

InChI=1S/C12H21NO.ClH/c1-10-6-4-7-11(2)13(10)9-5-8-12(3)14;/h10-12,14H,4,6-7,9H2,1-3H3;1H