(2R)-1-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-3-(2-methylpent-4-yn-2-yloxy)propan-2-ol

Systemtic Name: (2R)-1-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-3-(2-methylpent-4-yn-2-yloxy)propan-2-ol Openeye Name: (2R)-1-(1,1-dimethylbut-3-ynoxy)-3-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]-3-(2-methylpent-4-yn-2-yloxy)-2-propanol IUPAC Name: (2R)-1-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-3-(2-methylpent-4-yn-2-yloxy)propan-2-ol Traditional Name: (2R)-1-(1,1-dimethylbut-3-ynoxy)-3-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propan-2-ol Formula: C16H30NO2+ MolecularWeight: 268.4149

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(COC(C)(C)CC#C)O)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)C[C@H](COC(C)(C)CC#C)O)C

InChI

InChI=1S/C16H29NO2/c1-6-7-16(4,5)19-12-15(18)11-17-9-13(2)8-14(3)10-17/h1,13-15,18H,7-12H2,2-5H3/p+1/t13-,14-,15+/m0/s1