[(3R)-2,3-dimethyl-6-piperidin-1-ium-1-yl-hex-1-en-4-yn-3-yl] ethanoate

Systemtic Name: [(3R)-2,3-dimethyl-6-piperidin-1-ium-1-yl-hex-1-en-4-yn-3-yl] ethanoate Openeye Name: [(1R)-1-isopropenyl-1-methyl-4-piperidin-1-ium-1-yl-but-2-ynyl] acetate CAS Name: acetic acid [(3R)-2,3-dimethyl-6-(1-piperidin-1-iumyl)hex-1-en-4-yn-3-yl] ester IUPAC Name: [(3R)-2,3-dimethyl-6-piperidin-1-ium-1-ylhex-1-en-4-yn-3-yl] acetate Traditional Name: acetic acid [(1R)-1-isopropenyl-1-methyl-4-piperidin-1-ium-1-yl-but-2-ynyl] ester Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO2/c1-13(2)15(4,18-14(3)17)9-8-12-16-10-6-5-7-11-16/h1,5-7,10-12H2,2-4H3/p+1/t15-/m0/s1