tert-butyl (2S,4R)-2-[[(2S)-1-oxidanylidenepropan-2-yl]carbamoyl]-4-phenylmethoxy-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4R)-2-[[(2S)-1-oxidanylidenepropan-2-yl]carbamoyl]-4-phenylmethoxy-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,4R)-4-benzyloxy-2-[[(1S)-1-methyl-2-oxo-ethyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S,4R)-2-[oxo-[[(2S)-1-oxopropan-2-yl]amino]methyl]-4-phenylmethoxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4R)-2-[[(2S)-1-oxopropan-2-yl]carbamoyl]-4-phenylmethoxypyrrolidine-1-carboxylate Traditional Name: (2S,4R)-4-benzoxy-2-[[(1S)-2-keto-1-methyl-ethyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=O)NC(=O)C1CC(CN1C(=O)OC(C)(C)C)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C=O)NC(=O)[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)OCC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O5/c1-14(12-23)21-18(24)17-10-16(26-13-15-8-6-5-7-9-15)11-22(17)19(25)27-20(2,3)4/h5-9,12,14,16-17H,10-11,13H2,1-4H3,(H,21,24)/t14-,16+,17-/m0/s1