2-(4-fluoranylphenoxy)ethyl (3S)-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl (3S)-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: 2-(4-fluorophenoxy)ethyl (3S)-1-(2,4-dimethoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid 2-(4-fluorophenoxy)ethyl ester IUPAC Name: 2-(4-fluorophenoxy)ethyl (3S)-1-(2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2,4-dimethoxyphenyl)-5-keto-pyrrolidine-3-carboxylic acid 2-(4-fluorophenoxy)ethyl ester Formula: C21H22FNO6 MolecularWeight: 403.400883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CC(CC2=O)C(=O)OCCOC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C[C@H](CC2=O)C(=O)OCCOC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H22FNO6/c1-26-17-7-8-18(19(12-17)27-2)23-13-14(11-20(23)24)21(25)29-10-9-28-16-5-3-15(22)4-6-16/h3-8,12,14H,9-11,13H2,1-2H3/t14-/m0/s1