tert-butyl (2S,4R)-4-acetamido-2-phenethyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4R)-4-acetamido-2-phenethyl-piperidine-1-carboxylate Openeye Name: tert-butyl (2S,4R)-4-acetamido-2-phenethyl-piperidine-1-carboxylate CAS Name: (2S,4R)-4-acetamido-2-phenethyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4R)-4-acetamido-2-phenethylpiperidine-1-carboxylate Traditional Name: (2S,4R)-4-acetamido-2-phenethyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCN(C(C1)CCC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)N[C@@H]1CCN([C@H](C1)CCC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H30N2O3/c1-15(23)21-17-12-13-22(19(24)25-20(2,3)4)18(14-17)11-10-16-8-6-5-7-9-16/h5-9,17-18H,10-14H2,1-4H3,(H,21,23)/t17-,18+/m1/s1