N-[2-[1-[(2-fluoranyl-5-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-[1-[(2-fluoranyl-5-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Openeye Name: N-[2-[1-[(2-fluoro-5-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide CAS Name: N-[2-[1-[(2-fluoro-5-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[1-[(2-fluoro-5-methoxyphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Traditional Name: N-[2-[1-(2-fluoro-5-methoxy-benzyl)piperidin-1-ium-4-yl]pyrazol-3-yl]nicotinamide Formula: C22H25FN5O2+ MolecularWeight: 410.464603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)F)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H24FN5O2/c1-30-19-4-5-20(23)17(13-19)15-27-11-7-18(8-12-27)28-21(6-10-25-28)26-22(29)16-3-2-9-24-14-16/h2-6,9-10,13-14,18H,7-8,11-12,15H2,1H3,(H,26,29)/p+1