O1-tert-butyl O2-[(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[(1R)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-tert-butyl 2-O-[(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(1R)-2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)OC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C#N)OC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C20H25N3O5/c1-13(17(24)22-15-8-5-7-14(11-15)12-21)27-18(25)16-9-6-10-23(16)19(26)28-20(2,3)4/h5,7-8,11,13,16H,6,9-10H2,1-4H3,(H,22,24)/t13-,16+/m1/s1