(2S)-1-(1-ethynylcyclohexyl)oxy-3-(2,2,6,6-tetramethylpiperidin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2S)-1-(1-ethynylcyclohexyl)oxy-3-(2,2,6,6-tetramethylpiperidin-1-ium-1-yl)propan-2-ol Openeye Name: (2S)-1-(1-ethynylcyclohexoxy)-3-(2,2,6,6-tetramethylpiperidin-1-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(1-ethynylcyclohexyl)oxy-3-(2,2,6,6-tetramethyl-1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(1-ethynylcyclohexyl)oxy-3-(2,2,6,6-tetramethylpiperidin-1-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(1-ethynylcyclohexoxy)-3-(2,2,6,6-tetramethylpiperidin-1-ium-1-yl)propan-2-ol Formula: C20H36NO2+ MolecularWeight: 322.50534

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC([NH+]1CC(COC2(CCCCC2)C#C)O)(C)C)C

Isomeric SMILES

CC1(CCCC([NH+]1C[C@@H](COC2(CCCCC2)C#C)O)(C)C)C

InChI

InChI=1S/C20H35NO2/c1-6-20(13-8-7-9-14-20)23-16-17(22)15-21-18(2,3)11-10-12-19(21,4)5/h1,17,22H,7-16H2,2-5H3/p+1/t17-/m0/s1