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

Systemtic Name: 1-[(4-methylphenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-(p-tolylmethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-methylphenyl)methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[(4-methylphenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(4-methylbenzyl)piperidin-1-ium-4-carboxylate Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-]

InChI

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