5-[(2S,6R)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methyl-pent-3-yn-2-ol

Systemtic Name: 5-[(2S,6R)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methyl-pent-3-yn-2-ol Openeye Name: 5-[(2S,6R)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methyl-pent-3-yn-2-ol CAS Name: 5-[(2S,6R)-2,6-dimethyl-1-piperidin-1-iumyl]-2-methyl-3-pentyn-2-ol IUPAC Name: 5-[(2S,6R)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methylpent-3-yn-2-ol Traditional Name: 5-[(2S,6R)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methyl-pent-3-yn-2-ol Formula: C13H24NO+ MolecularWeight: 210.33576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]1CCC[C@@H]([NH+]1CC#CC(C)(C)O)C

InChI

InChI=1S/C13H23NO/c1-11-7-5-8-12(2)14(11)10-6-9-13(3,4)15/h11-12,15H,5,7-8,10H2,1-4H3/p+1/t11-,12+