tert-butyl (2R,5E)-5-[2-oxidanylidene-2-(3-phenylmethoxyphenyl)ethylidene]-1-(phenylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2R,5E)-5-[2-oxidanylidene-2-(3-phenylmethoxyphenyl)ethylidene]-1-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2R,5E)-1-benzyl-5-[2-(3-benzyloxyphenyl)-2-oxo-ethylidene]pyrrolidine-2-carboxylate CAS Name: (2R,5E)-5-[2-oxo-2-(3-phenylmethoxyphenyl)ethylidene]-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,5E)-1-benzyl-5-[2-oxo-2-(3-phenylmethoxyphenyl)ethylidene]pyrrolidine-2-carboxylate Traditional Name: (2R,5E)-5-[2-(3-benzoxyphenyl)-2-keto-ethylidene]-1-benzyl-pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C31H33NO4 MolecularWeight: 483.59802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCC(=CC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3)N1CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1CC/C(=C\C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3)/N1CC4=CC=CC=C4

InChI

InChI=1S/C31H33NO4/c1-31(2,3)36-30(34)28-18-17-26(32(28)21-23-11-6-4-7-12-23)20-29(33)25-15-10-16-27(19-25)35-22-24-13-8-5-9-14-24/h4-16,19-20,28H,17-18,21-22H2,1-3H3/b26-20+/t28-/m1/s1