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

Systemtic Name: ethyl (3R)-1-[(4-methylphenyl)methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-(p-tolylmethyl)piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-[(4-methylphenyl)methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[(4-methylphenyl)methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-(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)C1CCC[NH+](C1)CC2=CC=C(C=C2)C

Isomeric SMILES

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

InChI

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