[2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] (3S)-1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] (3S)-1-(2-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxo-ethyl] (3S)-1-(2-fluorophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] (3S)-1-(2-fluorophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-fluorophenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-[[4-(dimethylamino)benzyl]amino]-2-keto-ethyl] ester Formula: C22H24FN3O4 MolecularWeight: 413.442063

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)COC(=O)C2CC(=O)N(C2)C3=CC=CC=C3F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)COC(=O)[C@H]2CC(=O)N(C2)C3=CC=CC=C3F

InChI

InChI=1S/C22H24FN3O4/c1-25(2)17-9-7-15(8-10-17)12-24-20(27)14-30-22(29)16-11-21(28)26(13-16)19-6-4-3-5-18(19)23/h3-10,16H,11-14H2,1-2H3,(H,24,27)/t16-/m0/s1