1-[(5-chloranyl-2-methoxy-phenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-fluoro-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-fluoro-4-methoxy-phenyl)methyl]proline Formula: C20H21ClFNO4 MolecularWeight: 393.836443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClFNO4/c1-26-17-8-6-13(21)11-14(17)19(23-9-3-4-16(23)20(24)25)12-5-7-18(27-2)15(22)10-12/h5-8,10-11,16,19H,3-4,9H2,1-2H3,(H,24,25)