3-[[5-[2-fluoranyl-4-[[4-phenyl-3-(trifluoromethyl)phenoxy]methyl]phenyl]pyridin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-[2-fluoranyl-4-[[4-phenyl-3-(trifluoromethyl)phenoxy]methyl]phenyl]pyridin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[5-[2-fluoro-4-[[4-phenyl-3-(trifluoromethyl)phenoxy]methyl]phenyl]pyridine-2-carbonyl]amino]propanoic acid CAS Name: 3-[[[5-[2-fluoro-4-[[4-phenyl-3-(trifluoromethyl)phenoxy]methyl]phenyl]-2-pyridinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[5-[2-fluoro-4-[[4-phenyl-3-(trifluoromethyl)phenoxy]methyl]phenyl]pyridine-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[5-[2-fluoro-4-[[4-phenyl-3-(trifluoromethyl)phenoxy]methyl]phenyl]picolinoyl]amino]propionic acid Formula: C29H22F4N2O4 MolecularWeight: 538.489593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)OCC3=CC(=C(C=C3)C4=CN=C(C=C4)C(=O)NCCC(=O)O)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)OCC3=CC(=C(C=C3)C4=CN=C(C=C4)C(=O)NCCC(=O)O)F)C(F)(F)F

InChI

InChI=1S/C29H22F4N2O4/c30-25-14-18(6-9-23(25)20-7-11-26(35-16-20)28(38)34-13-12-27(36)37)17-39-21-8-10-22(19-4-2-1-3-5-19)24(15-21)29(31,32)33/h1-11,14-16H,12-13,17H2,(H,34,38)(H,36,37)