[(2R,4S,5R)-5-acetyloxy-5-methyl-2-phenyl-1-(phenylmethyl)piperidin-4-yl] ethanoate hydrochloride

Systemtic Name: [(2R,4S,5R)-5-acetyloxy-5-methyl-2-phenyl-1-(phenylmethyl)piperidin-4-yl] ethanoate hydrochloride Openeye Name: [(2R,4S,5R)-5-acetoxy-1-benzyl-5-methyl-2-phenyl-4-piperidyl] acetate hydrochloride CAS Name: acetic acid [(2R,4S,5R)-5-acetyloxy-5-methyl-2-phenyl-1-(phenylmethyl)-4-piperidinyl] ester hydrochloride IUPAC Name: [(2R,4S,5R)-5-acetyloxy-1-benzyl-5-methyl-2-phenylpiperidin-4-yl] acetate hydrochloride Traditional Name: acetic acid [(2R,4S,5R)-5-acetoxy-1-benzyl-5-methyl-2-phenyl-4-piperidyl] ester hydrochloride Formula: C23H28ClNO4 MolecularWeight: 417.92572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(N(CC1(C)OC(=O)C)CC2=CC=CC=C2)C3=CC=CC=C3.Cl

Isomeric SMILES

CC(=O)O[C@H]1C[C@@H](N(C[C@@]1(C)OC(=O)C)CC2=CC=CC=C2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C23H27NO4.ClH/c1-17(25)27-22-14-21(20-12-8-5-9-13-20)24(15-19-10-6-4-7-11-19)16-23(22,3)28-18(2)26;/h4-13,21-22H,14-16H2,1-3H3;1H/t21-,22+,23-;/m1./s1