(5-fluoranyl-2-methoxy-phenyl)methyl (3R)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate

Systemtic Name: (5-fluoranyl-2-methoxy-phenyl)methyl (3R)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate Openeye Name: (5-fluoro-2-methoxy-phenyl)methyl (3R)-5-oxo-1-phenethyl-pyrrolidine-3-carboxylate CAS Name: (3R)-5-oxo-1-phenethyl-3-pyrrolidinecarboxylic acid (5-fluoro-2-methoxyphenyl)methyl ester IUPAC Name: (5-fluoro-2-methoxyphenyl)methyl (3R)-5-oxo-1-phenethylpyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-phenethyl-pyrrolidine-3-carboxylic acid (5-fluoro-2-methoxy-benzyl) ester Formula: C21H22FNO4 MolecularWeight: 371.402083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)COC(=O)C2CC(=O)N(C2)CCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)F)COC(=O)[C@@H]2CC(=O)N(C2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H22FNO4/c1-26-19-8-7-18(22)11-17(19)14-27-21(25)16-12-20(24)23(13-16)10-9-15-5-3-2-4-6-15/h2-8,11,16H,9-10,12-14H2,1H3/t16-/m1/s1