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

Systemtic Name: [2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(2-ethylanilino)-2-oxo-ethyl] (3S)-1-(4-fluorophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(2-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethylanilino)-2-oxoethyl] (3S)-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(4-fluorophenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(2-ethylanilino)-2-keto-ethyl] ester Formula: C21H21FN2O4 MolecularWeight: 384.400843

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)COC(=O)[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O4/c1-2-14-5-3-4-6-18(14)23-19(25)13-28-21(27)15-11-20(26)24(12-15)17-9-7-16(22)8-10-17/h3-10,15H,2,11-13H2,1H3,(H,23,25)/t15-/m0/s1