O2-methyl O1-(phenylmethyl) (2S,5S)-5-methylsulfonyloxypiperidine-1,2-dicarboxylate

Systemtic Name: O2-methyl O1-(phenylmethyl) (2S,5S)-5-methylsulfonyloxypiperidine-1,2-dicarboxylate Openeye Name: O1-benzyl O2-methyl (2S,5S)-5-methylsulfonyloxypiperidine-1,2-dicarboxylate CAS Name: (2S,5S)-5-methylsulfonyloxypiperidine-1,2-dicarboxylic acid O2-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-methyl (2S,5S)-5-methylsulfonyloxypiperidine-1,2-dicarboxylate Traditional Name: (2S,5S)-5-methylsulfonyloxypiperidine-1,2-dicarboxylic acid O1-benzyl ester O2-methyl ester Formula: C16H21NO7S MolecularWeight: 371.40544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CN1C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

COC(=O)[C@@H]1CC[C@@H](CN1C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C16H21NO7S/c1-22-15(18)14-9-8-13(24-25(2,20)21)10-17(14)16(19)23-11-12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3/t13-,14-/m0/s1