(3R)-5-oxidanylidene-1-[(1S)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxylate

Systemtic Name: (3R)-5-oxidanylidene-1-[(1S)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxylate Openeye Name: (3R)-5-oxo-1-[(1S)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxylate CAS Name: (3R)-5-oxo-1-[(1S)-1-phenyl-2-(1-piperidin-1-iumyl)ethyl]-3-pyrrolidinecarboxylate IUPAC Name: (3R)-5-oxo-1-[(1S)-1-phenyl-2-piperidin-1-ium-1-ylethyl]pyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-[(1S)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxylate Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C2=CC=CC=C2)N3CC(CC3=O)C(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)C[C@H](C2=CC=CC=C2)N3C[C@@H](CC3=O)C(=O)[O-]

InChI

InChI=1S/C18H24N2O3/c21-17-11-15(18(22)23)12-20(17)16(14-7-3-1-4-8-14)13-19-9-5-2-6-10-19/h1,3-4,7-8,15-16H,2,5-6,9-13H2,(H,22,23)/t15-,16-/m1/s1