[(2S,3R,4S)-1,3-dimethyl-2,4-diphenyl-piperidin-4-yl] propanoate

Systemtic Name: [(2S,3R,4S)-1,3-dimethyl-2,4-diphenyl-piperidin-4-yl] propanoate Openeye Name: [(2S,3R,4S)-1,3-dimethyl-2,4-diphenyl-4-piperidyl] propanoate CAS Name: propanoic acid [(2S,3R,4S)-1,3-dimethyl-2,4-diphenyl-4-piperidinyl] ester IUPAC Name: [(2S,3R,4S)-1,3-dimethyl-2,4-diphenylpiperidin-4-yl] propanoate Traditional Name: propionic acid [(2S,3R,4S)-1,3-dimethyl-2,4-diphenyl-4-piperidyl] ester Formula: C22H27NO2 MolecularWeight: 337.45528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(CCN(C(C1C)C2=CC=CC=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)O[C@]1(CCN([C@@H]([C@H]1C)C2=CC=CC=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C22H27NO2/c1-4-20(24)25-22(19-13-9-6-10-14-19)15-16-23(3)21(17(22)2)18-11-7-5-8-12-18/h5-14,17,21H,4,15-16H2,1-3H3/t17-,21+,22+/m1/s1