O1-tert-butyl O2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C19H25ClN2O5 MolecularWeight: 396.8652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)OCC(=O)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC(=O)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H25ClN2O5/c1-19(2,3)27-18(25)22-10-4-5-15(22)17(24)26-12-16(23)21-11-13-6-8-14(20)9-7-13/h6-9,15H,4-5,10-12H2,1-3H3,(H,21,23)/t15-/m0/s1