2-[2-(3-fluoranyl-4-pyrrolidin-1-ylcarbonyl-phenyl)-4-(trifluoromethyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-(3-fluoranyl-4-pyrrolidin-1-ylcarbonyl-phenyl)-4-(trifluoromethyl)phenoxy]ethanoic acid Openeye Name: 2-[2-[3-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]-4-(trifluoromethyl)phenoxy]acetic acid CAS Name: 2-[2-[3-fluoro-4-[oxo(1-pyrrolidinyl)methyl]phenyl]-4-(trifluoromethyl)phenoxy]acetic acid IUPAC Name: 2-[2-[3-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]-4-(trifluoromethyl)phenoxy]acetic acid Traditional Name: 2-[2-[3-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]-4-(trifluoromethyl)phenoxy]acetic acid Formula: C20H17F4NO4 MolecularWeight: 411.346893

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=C(C=C2)C3=C(C=CC(=C3)C(F)(F)F)OCC(=O)O)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=C(C=C2)C3=C(C=CC(=C3)C(F)(F)F)OCC(=O)O)F

InChI

InChI=1S/C20H17F4NO4/c21-16-9-12(3-5-14(16)19(28)25-7-1-2-8-25)15-10-13(20(22,23)24)4-6-17(15)29-11-18(26)27/h3-6,9-10H,1-2,7-8,11H2,(H,26,27)