N-[3,5-dicyano-4-(2-fluorophenyl)-6-[(1-oxidanidylpyridin-1-ium-3-yl)methoxy]pyridin-2-yl]oxane-4-carboxamide

Systemtic Name: N-[3,5-dicyano-4-(2-fluorophenyl)-6-[(1-oxidanidylpyridin-1-ium-3-yl)methoxy]pyridin-2-yl]oxane-4-carboxamide Openeye Name: N-[3,5-dicyano-4-(2-fluorophenyl)-6-[(1-oxidopyridin-1-ium-3-yl)methoxy]-2-pyridyl]tetrahydropyran-4-carboxamide CAS Name: N-[3,5-dicyano-4-(2-fluorophenyl)-6-[(1-oxido-3-pyridin-1-iumyl)methoxy]-2-pyridinyl]-4-oxanecarboxamide IUPAC Name: N-[3,5-dicyano-4-(2-fluorophenyl)-6-[(1-oxidopyridin-1-ium-3-yl)methoxy]pyridin-2-yl]oxane-4-carboxamide Traditional Name: N-[3,5-dicyano-4-(2-fluorophenyl)-6-[(1-oxidopyridin-1-ium-3-yl)methoxy]-2-pyridyl]tetrahydropyran-4-carboxamide Formula: C25H20FN5O4 MolecularWeight: 473.455803

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)NC2=NC(=C(C(=C2C#N)C3=CC=CC=C3F)C#N)OCC4=C[N+](=CC=C4)[O-]

Isomeric SMILES

C1COCCC1C(=O)NC2=NC(=C(C(=C2C#N)C3=CC=CC=C3F)C#N)OCC4=C[N+](=CC=C4)[O-]

InChI

InChI=1S/C25H20FN5O4/c26-21-6-2-1-5-18(21)22-19(12-27)23(29-24(32)17-7-10-34-11-8-17)30-25(20(22)13-28)35-15-16-4-3-9-31(33)14-16/h1-6,9,14,17H,7-8,10-11,15H2,(H,29,30,32)