(4-piperidin-1-ium-1-ylcyclohexyl) 2-methylpropanoate chloride

Systemtic Name: (4-piperidin-1-ium-1-ylcyclohexyl) 2-methylpropanoate chloride Openeye Name: (4-piperidin-1-ium-1-ylcyclohexyl) 2-methylpropanoate chloride CAS Name: 2-methylpropanoic acid [4-(1-piperidin-1-iumyl)cyclohexyl] ester chloride IUPAC Name: (4-piperidin-1-ium-1-ylcyclohexyl) 2-methylpropanoate chloride Traditional Name: 2-methylpropionic acid (4-piperidin-1-ium-1-ylcyclohexyl) ester chloride Formula: C15H28ClNO2 MolecularWeight: 289.84132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1CCC(CC1)[NH+]2CCCCC2.[Cl-]

Isomeric SMILES

CC(C)C(=O)OC1CCC(CC1)[NH+]2CCCCC2.[Cl-]

InChI

InChI=1S/C15H27NO2.ClH/c1-12(2)15(17)18-14-8-6-13(7-9-14)16-10-4-3-5-11-16;/h12-14H,3-11H2,1-2H3;1H