ethyl (3R)-1-(3-phenylpropyl)piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-1-(3-phenylpropyl)piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-(3-phenylpropyl)piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-(3-phenylpropyl)-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-(3-phenylpropyl)piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-(3-phenylpropyl)piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C17H26NO2+ MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)CCCC2=CC=CC=C2

InChI

InChI=1S/C17H25NO2/c1-2-20-17(19)16-11-7-13-18(14-16)12-6-10-15-8-4-3-5-9-15/h3-5,8-9,16H,2,6-7,10-14H2,1H3/p+1/t16-/m1/s1