N-[(3R,4S)-3-methyl-1-[(2R)-2-oxidanyl-2-phenyl-ethyl]piperidin-1-ium-4-yl]-N-phenyl-propanamide

Systemtic Name: N-[(3R,4S)-3-methyl-1-[(2R)-2-oxidanyl-2-phenyl-ethyl]piperidin-1-ium-4-yl]-N-phenyl-propanamide Openeye Name: N-[(3R,4S)-1-[(2R)-2-hydroxy-2-phenyl-ethyl]-3-methyl-piperidin-1-ium-4-yl]-N-phenyl-propanamide CAS Name: N-[(3R,4S)-1-[(2R)-2-hydroxy-2-phenylethyl]-3-methyl-4-piperidin-1-iumyl]-N-phenylpropanamide IUPAC Name: N-[(3R,4S)-1-[(2R)-2-hydroxy-2-phenylethyl]-3-methylpiperidin-1-ium-4-yl]-N-phenylpropanamide Traditional Name: N-[(3R,4S)-1-[(2R)-2-hydroxy-2-phenyl-ethyl]-3-methyl-piperidin-1-ium-4-yl]-N-phenyl-propionamide Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC[NH+](CC1C)CC(C2=CC=CC=C2)O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O2/c1-3-23(27)25(20-12-8-5-9-13-20)21-14-15-24(16-18(21)2)17-22(26)19-10-6-4-7-11-19/h4-13,18,21-22,26H,3,14-17H2,1-2H3/p+1/t18-,21+,22+/m1/s1