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

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl] (3S)-1-(4-fluorophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl] (3S)-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(4-fluorophenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(4-acetamidoanilino)-2-keto-ethyl] ester Formula: C21H20FN3O5 MolecularWeight: 413.399003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O5/c1-13(26)23-16-4-6-17(7-5-16)24-19(27)12-30-21(29)14-10-20(28)25(11-14)18-8-2-15(22)3-9-18/h2-9,14H,10-12H2,1H3,(H,23,26)(H,24,27)/t14-/m0/s1