(1-methylpiperidin-1-ium-4-yl) 2-phenylethanoate chloride

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) 2-phenylethanoate chloride Openeye Name: (1-methylpiperidin-1-ium-4-yl) 2-phenylacetate chloride CAS Name: 2-phenylacetic acid (1-methyl-4-piperidin-1-iumyl) ester chloride IUPAC Name: (1-methylpiperidin-1-ium-4-yl) 2-phenylacetate chloride Traditional Name: 2-phenylacetic acid (1-methylpiperidin-1-ium-4-yl) ester chloride Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC(=O)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

C[NH+]1CCC(CC1)OC(=O)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C14H19NO2.ClH/c1-15-9-7-13(8-10-15)17-14(16)11-12-5-3-2-4-6-12;/h2-6,13H,7-11H2,1H3;1H