1-[(3,4-dimethoxyphenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-dimethoxyphenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-dimethoxyphenyl)-(4-fluorophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-dimethoxyphenyl)-(4-fluorophenyl)methyl]proline Formula: C20H22FNO4 MolecularWeight: 359.391383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FNO4/c1-25-17-10-7-14(12-18(17)26-2)19(13-5-8-15(21)9-6-13)22-11-3-4-16(22)20(23)24/h5-10,12,16,19H,3-4,11H2,1-2H3,(H,23,24)