O1-tert-butyl O3-methyl (3R,4S,5S)-4-oxidanyl-5-[(phenylmethyl)carbamoyl]piperidine-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-methyl (3R,4S,5S)-4-oxidanyl-5-[(phenylmethyl)carbamoyl]piperidine-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-methyl (3R,4S,5S)-5-(benzylcarbamoyl)-4-hydroxy-piperidine-1,3-dicarboxylate CAS Name: (3R,4S,5S)-4-hydroxy-5-[oxo-[(phenylmethyl)amino]methyl]piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester IUPAC Name: 1-O-tert-butyl 3-O-methyl (3R,4S,5S)-5-(benzylcarbamoyl)-4-hydroxypiperidine-1,3-dicarboxylate Traditional Name: (3R,4S,5S)-5-(benzylcarbamoyl)-4-hydroxy-piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C(C(C1)C(=O)OC)O)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H]([C@@H]([C@@H](C1)C(=O)OC)O)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O6/c1-20(2,3)28-19(26)22-11-14(16(23)15(12-22)18(25)27-4)17(24)21-10-13-8-6-5-7-9-13/h5-9,14-16,23H,10-12H2,1-4H3,(H,21,24)/t14-,15+,16-/m0/s1