O4-tert-butyl O2-ethyl (2R,4R,5S)-5-(4-cyanophenyl)pyrrolidine-2,4-dicarboxylate

Systemtic Name: O4-tert-butyl O2-ethyl (2R,4R,5S)-5-(4-cyanophenyl)pyrrolidine-2,4-dicarboxylate Openeye Name: O4-tert-butyl O2-ethyl (2R,4R,5S)-5-(4-cyanophenyl)pyrrolidine-2,4-dicarboxylate CAS Name: (2R,4R,5S)-5-(4-cyanophenyl)pyrrolidine-2,4-dicarboxylic acid O4-tert-butyl ester O2-ethyl ester IUPAC Name: 4-O-tert-butyl 2-O-ethyl (2R,4R,5S)-5-(4-cyanophenyl)pyrrolidine-2,4-dicarboxylate Traditional Name: (2R,4R,5S)-5-(4-cyanophenyl)pyrrolidine-2,4-dicarboxylic acid O4-tert-butyl ester O2-ethyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C(N1)C2=CC=C(C=C2)C#N)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H]1C[C@H]([C@H](N1)C2=CC=C(C=C2)C#N)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H24N2O4/c1-5-24-18(23)15-10-14(17(22)25-19(2,3)4)16(21-15)13-8-6-12(11-20)7-9-13/h6-9,14-16,21H,5,10H2,1-4H3/t14-,15-,16-/m1/s1