ethyl (3R)-3-[(4-methylphenyl)methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-3-[(4-methylphenyl)methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-3-(p-tolylmethyl)piperidin-1-ium-3-carboxylate CAS Name: (3R)-3-[(4-methylphenyl)methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(4-methylphenyl)methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-3-(4-methylbenzyl)piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC[NH2+]C1)CC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)[C@]1(CCC[NH2+]C1)CC2=CC=C(C=C2)C

InChI

InChI=1S/C16H23NO2/c1-3-19-15(18)16(9-4-10-17-12-16)11-14-7-5-13(2)6-8-14/h5-8,17H,3-4,9-12H2,1-2H3/p+1/t16-/m1/s1