methyl (3R,4R)-3-methyl-1-(2-oxidanyl-2-phenyl-ethyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl (3R,4R)-3-methyl-1-(2-oxidanyl-2-phenyl-ethyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: methyl (3R,4R)-1-(2-hydroxy-2-phenyl-ethyl)-3-methyl-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: (3R,4R)-1-(2-hydroxy-2-phenylethyl)-3-methyl-4-[N-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (3R,4R)-1-(2-hydroxy-2-phenylethyl)-3-methyl-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: (3R,4R)-1-(2-hydroxy-2-phenyl-ethyl)-3-methyl-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C25H32N2O4 MolecularWeight: 424.53258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2C)CC(C3=CC=CC=C3)O)C(=O)OC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)[C@@]2(CCN(C[C@H]2C)CC(C3=CC=CC=C3)O)C(=O)OC

InChI

InChI=1S/C25H32N2O4/c1-4-23(29)27(21-13-9-6-10-14-21)25(24(30)31-3)15-16-26(17-19(25)2)18-22(28)20-11-7-5-8-12-20/h5-14,19,22,28H,4,15-18H2,1-3H3/t19-,22?,25-/m1/s1