2-[3-fluoranyl-4-[4-[(1-methyl-1-oxidanyl-pyridin-1-ium-2-id-2-yl)methoxy]phenyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-fluoranyl-4-[4-[(1-methyl-1-oxidanyl-pyridin-1-ium-2-id-2-yl)methoxy]phenyl]phenyl]ethanoic acid Openeye Name: 2-[3-fluoro-4-[4-[(1-hydroxy-1-methyl-pyridin-1-ium-2-id-2-yl)methoxy]phenyl]phenyl]acetic acid CAS Name: 2-[3-fluoro-4-[4-[(1-hydroxy-1-methyl-2-pyridin-1-ium-2-idyl)methoxy]phenyl]phenyl]acetic acid IUPAC Name: 2-[3-fluoro-4-[4-[(1-hydroxy-1-methylpyridin-1-ium-2-id-2-yl)methoxy]phenyl]phenyl]acetic acid Traditional Name: 2-[3-fluoro-4-[4-[(1-hydroxy-1-methyl-pyridin-1-ium-2-id-2-yl)methoxy]phenyl]phenyl]acetic acid Formula: C21H20FNO4 MolecularWeight: 369.386203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C=CC=C[C-]1COC2=CC=C(C=C2)C3=C(C=C(C=C3)CC(=O)O)F)O

Isomeric SMILES

C[N+]1(C=CC=C[C-]1COC2=CC=C(C=C2)C3=C(C=C(C=C3)CC(=O)O)F)O

InChI

InChI=1S/C21H20FNO4/c1-23(26)11-3-2-4-17(23)14-27-18-8-6-16(7-9-18)19-10-5-15(12-20(19)22)13-21(24)25/h2-12,26H,13-14H2,1H3,(H,24,25)