ethyl (2R)-1-[(3-methylphenyl)methyl]piperidin-1-ium-2-carboxylate

Systemtic Name: ethyl (2R)-1-[(3-methylphenyl)methyl]piperidin-1-ium-2-carboxylate Openeye Name: ethyl (2R)-1-(m-tolylmethyl)piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[(3-methylphenyl)methyl]-2-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-[(3-methylphenyl)methyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-(3-methylbenzyl)piperidin-1-ium-2-carboxylic acid ethyl ester Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC[NH+]1CC2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCC[NH+]1CC2=CC=CC(=C2)C

InChI

InChI=1S/C16H23NO2/c1-3-19-16(18)15-9-4-5-10-17(15)12-14-8-6-7-13(2)11-14/h6-8,11,15H,3-5,9-10,12H2,1-2H3/p+1/t15-/m1/s1