2-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]ethanoate

Systemtic Name: 2-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]ethanoate Openeye Name: 2-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]acetate CAS Name: 2-[1-[(4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]acetate IUPAC Name: 2-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]acetate Traditional Name: 2-(1-p-anisylpiperidin-1-ium-4-yl)acetate Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCC(CC2)CC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCC(CC2)CC(=O)[O-]

InChI

InChI=1S/C15H21NO3/c1-19-14-4-2-13(3-5-14)11-16-8-6-12(7-9-16)10-15(17)18/h2-5,12H,6-11H2,1H3,(H,17,18)