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

Systemtic Name: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-fluoroanilino)-2-oxo-ethyl] 1-(4-ethoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoroanilino)-2-oxoethyl] 1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-p-phenetyl-pyrrolidine-3-carboxylic acid [2-(4-fluoroanilino)-2-keto-ethyl] ester Formula: C21H21FN2O5 MolecularWeight: 400.400243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O5/c1-2-28-18-9-7-17(8-10-18)24-12-14(11-20(24)26)21(27)29-13-19(25)23-16-5-3-15(22)4-6-16/h3-10,14H,2,11-13H2,1H3,(H,23,25)