1-[(2,3-dimethoxyphenyl)-(5-fluoranyl-2-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,3-dimethoxyphenyl)-(5-fluoranyl-2-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,3-dimethoxyphenyl)-(5-fluoro-2-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,3-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,3-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,3-dimethoxyphenyl)-(5-fluoro-2-methoxy-phenyl)methyl]proline Formula: C21H24FNO5 MolecularWeight: 389.417363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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