methyl 2-[1-(3-methylbut-2-enyl)piperidin-1-ium-1-yl]ethanoate chloride

Systemtic Name: methyl 2-[1-(3-methylbut-2-enyl)piperidin-1-ium-1-yl]ethanoate chloride Openeye Name: methyl 2-[1-(3-methylbut-2-enyl)piperidin-1-ium-1-yl]acetate chloride CAS Name: 2-[1-(3-methylbut-2-enyl)-1-piperidin-1-iumyl]acetic acid methyl ester chloride IUPAC Name: methyl 2-[1-(3-methylbut-2-enyl)piperidin-1-ium-1-yl]acetate chloride Traditional Name: 2-[1-(3-methylbut-2-enyl)piperidin-1-ium-1-yl]acetic acid methyl ester chloride Formula: C13H24ClNO2 MolecularWeight: 261.78816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[N+]1(CCCCC1)CC(=O)OC)C.[Cl-]

Isomeric SMILES

CC(=CC[N+]1(CCCCC1)CC(=O)OC)C.[Cl-]

InChI

InChI=1S/C13H24NO2.ClH/c1-12(2)7-10-14(11-13(15)16-3)8-5-4-6-9-14;/h7H,4-6,8-11H2,1-3H3;1H/q+1;/p-1