O1-tert-butyl O2-methyl (2S,3R,5S)-3-(2-methoxy-2-oxidanylidene-ethyl)-5-phenyl-piperidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl (2S,3R,5S)-3-(2-methoxy-2-oxidanylidene-ethyl)-5-phenyl-piperidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2S,3R,5S)-3-(2-methoxy-2-oxo-ethyl)-5-phenyl-piperidine-1,2-dicarboxylate CAS Name: (2S,3R,5S)-3-(2-methoxy-2-oxoethyl)-5-phenylpiperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S,3R,5S)-3-(2-methoxy-2-oxoethyl)-5-phenylpiperidine-1,2-dicarboxylate Traditional Name: (2S,3R,5S)-3-(2-keto-2-methoxy-ethyl)-5-phenyl-piperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC(C1C(=O)OC)CC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]([C@H]1C(=O)OC)CC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C21H29NO6/c1-21(2,3)28-20(25)22-13-16(14-9-7-6-8-10-14)11-15(12-17(23)26-4)18(22)19(24)27-5/h6-10,15-16,18H,11-13H2,1-5H3/t15-,16-,18+/m1/s1