tert-butyl (3S,4S)-3-oxidanyl-4-[[(phenylmethyl)amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (3S,4S)-3-oxidanyl-4-[[(phenylmethyl)amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl (3S,4S)-4-[(benzylamino)methyl]-3-hydroxy-piperidine-1-carboxylate CAS Name: (3S,4S)-3-hydroxy-4-[[(phenylmethyl)amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S)-4-[(benzylamino)methyl]-3-hydroxypiperidine-1-carboxylate Traditional Name: (3S,4S)-4-[(benzylamino)methyl]-3-hydroxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1)O)CNCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@H]([C@@H](C1)O)CNCC2=CC=CC=C2

InChI

InChI=1S/C18H28N2O3/c1-18(2,3)23-17(22)20-10-9-15(16(21)13-20)12-19-11-14-7-5-4-6-8-14/h4-8,15-16,19,21H,9-13H2,1-3H3/t15-,16+/m0/s1