3-[2-[3-(5-azanylpyridin-2-yl)phenoxy]pyridin-4-yl]-3-(2-fluorophenyl)propanoic acid

Systemtic Name: 3-[2-[3-(5-azanylpyridin-2-yl)phenoxy]pyridin-4-yl]-3-(2-fluorophenyl)propanoic acid Openeye Name: 3-[2-[3-(5-amino-2-pyridyl)phenoxy]-4-pyridyl]-3-(2-fluorophenyl)propanoic acid CAS Name: 3-[2-[3-(5-amino-2-pyridinyl)phenoxy]-4-pyridinyl]-3-(2-fluorophenyl)propanoic acid IUPAC Name: 3-[2-[3-(5-aminopyridin-2-yl)phenoxy]pyridin-4-yl]-3-(2-fluorophenyl)propanoic acid Traditional Name: 3-[2-[3-(5-amino-2-pyridyl)phenoxy]-4-pyridyl]-3-(2-fluorophenyl)propionic acid Formula: C25H20FN3O3 MolecularWeight: 429.443003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(CC(=O)O)C2=CC(=NC=C2)OC3=CC=CC(=C3)C4=NC=C(C=C4)N)F

Isomeric SMILES

C1=CC=C(C(=C1)C(CC(=O)O)C2=CC(=NC=C2)OC3=CC=CC(=C3)C4=NC=C(C=C4)N)F

InChI

InChI=1S/C25H20FN3O3/c26-22-7-2-1-6-20(22)21(14-25(30)31)16-10-11-28-24(13-16)32-19-5-3-4-17(12-19)23-9-8-18(27)15-29-23/h1-13,15,21H,14,27H2,(H,30,31)