ditert-butyl (2S,4E)-5-oxidanylidene-4-(phenylmethylidene)pyrrolidine-1,2-dicarboxylate

Systemtic Name: ditert-butyl (2S,4E)-5-oxidanylidene-4-(phenylmethylidene)pyrrolidine-1,2-dicarboxylate Openeye Name: ditert-butyl (2S,4E)-4-benzylidene-5-oxo-pyrrolidine-1,2-dicarboxylate CAS Name: (2S,4E)-5-oxo-4-(phenylmethylene)pyrrolidine-1,2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S,4E)-4-benzylidene-5-oxopyrrolidine-1,2-dicarboxylate Traditional Name: (2S,4E)-4-benzal-5-keto-pyrrolidine-1,2-dicarboxylic acid ditert-butyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC(=CC2=CC=CC=C2)C(=O)N1C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1C/C(=C\C2=CC=CC=C2)/C(=O)N1C(=O)OC(C)(C)C

InChI

InChI=1S/C21H27NO5/c1-20(2,3)26-18(24)16-13-15(12-14-10-8-7-9-11-14)17(23)22(16)19(25)27-21(4,5)6/h7-12,16H,13H2,1-6H3/b15-12+/t16-/m0/s1