(phenylmethyl) (3R,4S)-4-ethyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-2-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: (phenylmethyl) (3R,4S)-4-ethyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-2-oxidanylidene-piperidine-3-carboxylate Openeye Name: benzyl (3R,4S)-1-(2-tert-butoxy-2-oxo-ethyl)-4-ethyl-2-oxo-piperidine-3-carboxylate CAS Name: (3R,4S)-4-ethyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2-oxo-3-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3R,4S)-4-ethyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2-oxopiperidine-3-carboxylate Traditional Name: (3R,4S)-1-(2-tert-butoxy-2-keto-ethyl)-4-ethyl-2-keto-nipecotic acid benzyl ester Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCN(C(=O)C1C(=O)OCC2=CC=CC=C2)CC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO5/c1-5-16-11-12-22(13-17(23)27-21(2,3)4)19(24)18(16)20(25)26-14-15-9-7-6-8-10-15/h6-10,16,18H,5,11-14H2,1-4H3/t16-,18+/m0/s1