tert-butyl 2-[(3R,4R)-4-ethyl-2-oxidanylidene-3-(phenylmethoxycarbonylamino)piperidin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[(3R,4R)-4-ethyl-2-oxidanylidene-3-(phenylmethoxycarbonylamino)piperidin-1-yl]ethanoate Openeye Name: tert-butyl 2-[(3R,4R)-3-(benzyloxycarbonylamino)-4-ethyl-2-oxo-1-piperidyl]acetate CAS Name: 2-[(3R,4R)-4-ethyl-2-oxo-3-(phenylmethoxycarbonylamino)-1-piperidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3R,4R)-4-ethyl-2-oxo-3-(phenylmethoxycarbonylamino)piperidin-1-yl]acetate Traditional Name: 2-[(3R,4R)-3-(benzyloxycarbonylamino)-4-ethyl-2-keto-piperidino]acetic acid tert-butyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCN(C(=O)C1NC(=O)OCC2=CC=CC=C2)CC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@@H]1CCN(C(=O)[C@@H]1NC(=O)OCC2=CC=CC=C2)CC(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O5/c1-5-16-11-12-23(13-17(24)28-21(2,3)4)19(25)18(16)22-20(26)27-14-15-9-7-6-8-10-15/h6-10,16,18H,5,11-14H2,1-4H3,(H,22,26)/t16-,18-/m1/s1