O3-methyl O1-(phenylmethyl) (3R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-piperidine-1,3-dicarboxylate

Systemtic Name: O3-methyl O1-(phenylmethyl) (3R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-piperidine-1,3-dicarboxylate Openeye Name: O1-benzyl O3-methyl (3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)piperidine-1,3-dicarboxylate CAS Name: (3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)piperidine-1,3-dicarboxylic acid O3-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 3-O-methyl (3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)piperidine-1,3-dicarboxylate Traditional Name: (3R,4S,5R)-4-hydroxy-5-methylol-piperidine-1,3-dicarboxylic acid O1-benzyl ester O3-methyl ester Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CC(C1O)CO)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1CN(C[C@@H]([C@@H]1O)CO)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H21NO6/c1-22-15(20)13-8-17(7-12(9-18)14(13)19)16(21)23-10-11-5-3-2-4-6-11/h2-6,12-14,18-19H,7-10H2,1H3/t12-,13-,14+/m1/s1