O1-tert-butyl O2-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O2-[2-(3-acetylanilino)-2-oxo-ethyl] O1-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O2-[2-(3-acetylanilino)-2-oxoethyl] ester O1-tert-butyl ester IUPAC Name: 2-O-[2-(3-acetylanilino)-2-oxoethyl] 1-O-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O2-[2-(3-acetylanilino)-2-keto-ethyl] ester O1-tert-butyl ester Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)COC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)COC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C20H26N2O6/c1-13(23)14-7-5-8-15(11-14)21-17(24)12-27-18(25)16-9-6-10-22(16)19(26)28-20(2,3)4/h5,7-8,11,16H,6,9-10,12H2,1-4H3,(H,21,24)/t16-/m0/s1