ethyl (2S,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-[(1R)-1-phenylethyl]piperidine-2-carboxylate

Systemtic Name: ethyl (2S,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-[(1R)-1-phenylethyl]piperidine-2-carboxylate Openeye Name: ethyl (2S,4S)-4-(tert-butoxycarbonylamino)-1-[(1R)-1-phenylethyl]piperidine-2-carboxylate CAS Name: (2S,4S)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-[(1R)-1-phenylethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-[(1R)-1-phenylethyl]piperidine-2-carboxylate Traditional Name: (2S,4S)-4-(tert-butoxycarbonylamino)-1-[(1R)-1-phenylethyl]pipecolinic acid ethyl ester Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CCN1C(C)C2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@@H]1C[C@H](CCN1[C@H](C)C2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N2O4/c1-6-26-19(24)18-14-17(22-20(25)27-21(3,4)5)12-13-23(18)15(2)16-10-8-7-9-11-16/h7-11,15,17-18H,6,12-14H2,1-5H3,(H,22,25)/t15-,17+,18+/m1/s1