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

Systemtic Name: O1-tert-butyl O2-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxo-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxoethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-[(4-carbomethoxybenzyl)amino]-2-keto-ethyl] ester Formula: C21H28N2O7 MolecularWeight: 420.45622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O7/c1-21(2,3)30-20(27)23-11-5-6-16(23)19(26)29-13-17(24)22-12-14-7-9-15(10-8-14)18(25)28-4/h7-10,16H,5-6,11-13H2,1-4H3,(H,22,24)/t16-/m0/s1