(5-fluoranyl-2-methoxy-phenyl)methyl (3R)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (5-fluoranyl-2-methoxy-phenyl)methyl (3R)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (5-fluoro-2-methoxy-phenyl)methyl (3R)-1-(5-chloro-2,4-dimethoxy-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-(5-chloro-2,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (5-fluoro-2-methoxyphenyl)methyl ester IUPAC Name: (5-fluoro-2-methoxyphenyl)methyl (3R)-1-(5-chloro-2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-(5-chloro-2,4-dimethoxy-phenyl)-5-keto-pyrrolidine-3-carboxylic acid (5-fluoro-2-methoxy-benzyl) ester Formula: C21H21ClFNO6 MolecularWeight: 437.845943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)COC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)F)COC(=O)[C@@H]2CC(=O)N(C2)C3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C21H21ClFNO6/c1-27-17-5-4-14(23)6-13(17)11-30-21(26)12-7-20(25)24(10-12)16-8-15(22)18(28-2)9-19(16)29-3/h4-6,8-9,12H,7,10-11H2,1-3H3/t12-/m1/s1