tert-butyl (2S)-2-[4-oxidanylidene-4-phenylmethoxy-3-(phenylmethyl)butanoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[4-oxidanylidene-4-phenylmethoxy-3-(phenylmethyl)butanoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-(3-benzyl-4-benzyloxy-4-oxo-butanoyl)pyrrolidine-1-carboxylate CAS Name: (2S)-2-[1,4-dioxo-4-phenylmethoxy-3-(phenylmethyl)butyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(3-benzyl-4-oxo-4-phenylmethoxybutanoyl)pyrrolidine-1-carboxylate Traditional Name: (2S)-2-(4-benzoxy-3-benzyl-4-keto-butanoyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C27H33NO5 MolecularWeight: 451.55462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)CC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)CC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H33NO5/c1-27(2,3)33-26(31)28-16-10-15-23(28)24(29)18-22(17-20-11-6-4-7-12-20)25(30)32-19-21-13-8-5-9-14-21/h4-9,11-14,22-23H,10,15-19H2,1-3H3/t22?,23-/m0/s1