(3-methyl-6-piperidin-1-ium-1-yl-hex-4-yn-3-yl) ethanoate chloride

Systemtic Name: (3-methyl-6-piperidin-1-ium-1-yl-hex-4-yn-3-yl) ethanoate chloride Openeye Name: (1-ethyl-1-methyl-4-piperidin-1-ium-1-yl-but-2-ynyl) acetate chloride CAS Name: acetic acid [3-methyl-6-(1-piperidin-1-iumyl)hex-4-yn-3-yl] ester chloride IUPAC Name: (3-methyl-6-piperidin-1-ium-1-ylhex-4-yn-3-yl) acetate chloride Traditional Name: acetic acid (1-ethyl-1-methyl-4-piperidin-1-ium-1-yl-but-2-ynyl) ester chloride Formula: C14H24ClNO2 MolecularWeight: 273.79886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO2.ClH/c1-4-14(3,17-13(2)16)9-8-12-15-10-6-5-7-11-15;/h4-7,10-12H2,1-3H3;1H