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

Systemtic Name: (phenylmethyl) (3R,4S)-4-cyano-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-cyano-2-oxo-piperidine-3-carboxylate CAS Name: (3R,4S)-4-cyano-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2-oxo-3-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3R,4S)-4-cyano-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-cyano-2-keto-nipecotic acid benzyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCC(C(C1=O)C(=O)OCC2=CC=CC=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CN1CC[C@@H]([C@H](C1=O)C(=O)OCC2=CC=CC=C2)C#N

InChI

InChI=1S/C20H24N2O5/c1-20(2,3)27-16(23)12-22-10-9-15(11-21)17(18(22)24)19(25)26-13-14-7-5-4-6-8-14/h4-8,15,17H,9-10,12-13H2,1-3H3/t15-,17-/m1/s1