ethyl 1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(2R)-2-phenylpropyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H26NO2+ MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC(C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)C[C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C17H25NO2/c1-3-20-17(19)16-9-11-18(12-10-16)13-14(2)15-7-5-4-6-8-15/h4-8,14,16H,3,9-13H2,1-2H3/p+1/t14-/m0/s1