1-[(2-methylphenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[(2-methylphenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-(o-tolylmethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-[(2-methylphenyl)methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[(2-methylphenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(2-methylbenzyl)piperidin-1-ium-4-carboxylate Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)C(=O)[O-]

InChI

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