1-[(2,6-dimethoxyphenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(3-fluoro-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-(3-fluoro-4-methoxy-phenyl)methyl]proline Formula: C21H24FNO5 MolecularWeight: 389.417363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CC(=C(C=C2)OC)F)N3CCCC3C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CC(=C(C=C2)OC)F)N3CCCC3C(=O)O

InChI

InChI=1S/C21H24FNO5/c1-26-16-10-9-13(12-14(16)22)20(23-11-5-6-15(23)21(24)25)19-17(27-2)7-4-8-18(19)28-3/h4,7-10,12,15,20H,5-6,11H2,1-3H3,(H,24,25)