2-[(2R,6S)-1,1-dimethyl-6-[(2S)-2-oxidanyl-2-phenyl-ethyl]piperidin-1-ium-2-yl]-1-phenyl-ethanone iodide

Systemtic Name: 2-[(2R,6S)-1,1-dimethyl-6-[(2S)-2-oxidanyl-2-phenyl-ethyl]piperidin-1-ium-2-yl]-1-phenyl-ethanone iodide Openeye Name: 2-[(2R,6S)-6-[(2S)-2-hydroxy-2-phenyl-ethyl]-1,1-dimethyl-piperidin-1-ium-2-yl]-1-phenyl-ethanone iodide CAS Name: 2-[(2R,6S)-6-[(2S)-2-hydroxy-2-phenylethyl]-1,1-dimethyl-2-piperidin-1-iumyl]-1-phenylethanone iodide IUPAC Name: 2-[(2R,6S)-6-[(2S)-2-hydroxy-2-phenylethyl]-1,1-dimethylpiperidin-1-ium-2-yl]-1-phenylethanone iodide Traditional Name: 2-[(2R,6S)-6-[(2S)-2-hydroxy-2-phenyl-ethyl]-1,1-dimethyl-piperidin-1-ium-2-yl]-1-phenyl-ethanone iodide Formula: C23H30INO2 MolecularWeight: 479.39427

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(CCCC1CC(=O)C2=CC=CC=C2)CC(C3=CC=CC=C3)O)C.[I-]

Isomeric SMILES

C[N+]1([C@@H](CCC[C@@H]1CC(=O)C2=CC=CC=C2)C[C@@H](C3=CC=CC=C3)O)C.[I-]

InChI

InChI=1S/C23H30NO2.HI/c1-24(2)20(16-22(25)18-10-5-3-6-11-18)14-9-15-21(24)17-23(26)19-12-7-4-8-13-19;/h3-8,10-13,20-22,25H,9,14-17H2,1-2H3;1H/q+1;/p-1/t20-,21+,22-;/m0./s1