ethyl (3R)-3-phenyl-3-piperidin-1-ium-4-yl-propanoate

Systemtic Name: ethyl (3R)-3-phenyl-3-piperidin-1-ium-4-yl-propanoate Openeye Name: ethyl (3R)-3-phenyl-3-piperidin-1-ium-4-yl-propanoate CAS Name: (3R)-3-phenyl-3-(4-piperidin-1-iumyl)propanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-phenyl-3-piperidin-1-ium-4-ylpropanoate Traditional Name: (3R)-3-phenyl-3-piperidin-1-ium-4-yl-propionic acid ethyl ester Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1CC[NH2+]CC1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C[C@H](C1CC[NH2+]CC1)C2=CC=CC=C2

InChI

InChI=1S/C16H23NO2/c1-2-19-16(18)12-15(13-6-4-3-5-7-13)14-8-10-17-11-9-14/h3-7,14-15,17H,2,8-12H2,1H3/p+1/t15-/m0/s1