2-[2,6-bis(fluoranyl)-4-(1-oxidanidylpyridin-1-ium-4-yl)phenyl]-2-methoxy-ethanoic acid

Systemtic Name: 2-[2,6-bis(fluoranyl)-4-(1-oxidanidylpyridin-1-ium-4-yl)phenyl]-2-methoxy-ethanoic acid Openeye Name: 2-[2,6-difluoro-4-(1-oxidopyridin-1-ium-4-yl)phenyl]-2-methoxy-acetic acid CAS Name: 2-[2,6-difluoro-4-(1-oxido-4-pyridin-1-iumyl)phenyl]-2-methoxyacetic acid IUPAC Name: 2-[2,6-difluoro-4-(1-oxidopyridin-1-ium-4-yl)phenyl]-2-methoxyacetic acid Traditional Name: 2-[2,6-difluoro-4-(1-oxidopyridin-1-ium-4-yl)phenyl]-2-methoxy-acetic acid Formula: C14H11F2NO4 MolecularWeight: 295.238246

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=C(C=C(C=C1F)C2=CC=[N+](C=C2)[O-])F)C(=O)O

Isomeric SMILES

COC(C1=C(C=C(C=C1F)C2=CC=[N+](C=C2)[O-])F)C(=O)O

InChI

InChI=1S/C14H11F2NO4/c1-21-13(14(18)19)12-10(15)6-9(7-11(12)16)8-2-4-17(20)5-3-8/h2-7,13H,1H3,(H,18,19)