O1-tert-butyl O2-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-oxo-2-[4-(1-pyrrolidinyl)anilino]ethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-keto-2-(4-pyrrolidinoanilino)ethyl] ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C22H31N3O5/c1-22(2,3)30-21(28)25-14-6-7-18(25)20(27)29-15-19(26)23-16-8-10-17(11-9-16)24-12-4-5-13-24/h8-11,18H,4-7,12-15H2,1-3H3,(H,23,26)/t18-/m0/s1