(phenylmethyl) (3S,4R,6S)-6-(hydroxymethyl)-2-oxidanylidene-4-phenyl-piperidine-3-carboxylate

Systemtic Name: (phenylmethyl) (3S,4R,6S)-6-(hydroxymethyl)-2-oxidanylidene-4-phenyl-piperidine-3-carboxylate Openeye Name: benzyl (3S,4R,6S)-6-(hydroxymethyl)-2-oxo-4-phenyl-piperidine-3-carboxylate CAS Name: (3S,4R,6S)-6-(hydroxymethyl)-2-oxo-4-phenyl-3-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S,4R,6S)-6-(hydroxymethyl)-2-oxo-4-phenylpiperidine-3-carboxylate Traditional Name: (3S,4R,6S)-2-keto-6-methylol-4-phenyl-nipecotic acid benzyl ester Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C(C1C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)CO

Isomeric SMILES

C1[C@H](NC(=O)[C@H]([C@@H]1C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)CO

InChI

InChI=1S/C20H21NO4/c22-12-16-11-17(15-9-5-2-6-10-15)18(19(23)21-16)20(24)25-13-14-7-3-1-4-8-14/h1-10,16-18,22H,11-13H2,(H,21,23)/t16-,17-,18-/m0/s1