1-[(4-ethoxyphenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[(4-ethoxyphenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[(4-ethoxyphenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-ethoxyphenyl)methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[(4-ethoxyphenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(4-ethoxybenzyl)piperidin-1-ium-4-carboxylate Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-]

InChI

InChI=1S/C15H21NO3/c1-2-19-14-5-3-12(4-6-14)11-16-9-7-13(8-10-16)15(17)18/h3-6,13H,2,7-11H2,1H3,(H,17,18)