[(4R)-4-methyl-1-piperidin-1-ium-1-yl-oct-7-en-2-yn-4-yl] ethanoate

Systemtic Name: [(4R)-4-methyl-1-piperidin-1-ium-1-yl-oct-7-en-2-yn-4-yl] ethanoate Openeye Name: [(1R)-1-methyl-1-(3-piperidin-1-ium-1-ylprop-1-ynyl)pent-4-enyl] acetate CAS Name: acetic acid [(4R)-4-methyl-1-(1-piperidin-1-iumyl)oct-7-en-2-yn-4-yl] ester IUPAC Name: [(4R)-4-methyl-1-piperidin-1-ium-1-yloct-7-en-2-yn-4-yl] acetate Traditional Name: acetic acid [(1R)-1-methyl-1-(3-piperidin-1-ium-1-ylprop-1-ynyl)pent-4-enyl] ester Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(CCC=C)C#CC[NH+]1CCCCC1

Isomeric SMILES

CC(=O)O[C@](C)(CCC=C)C#CC[NH+]1CCCCC1

InChI

InChI=1S/C16H25NO2/c1-4-5-10-16(3,19-15(2)18)11-9-14-17-12-7-6-8-13-17/h4H,1,5-8,10,12-14H2,2-3H3/p+1/t16-/m1/s1