[2-(2-fluoranylphenoxy)pyridin-3-yl]methyl-(1-propylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [2-(2-fluoranylphenoxy)pyridin-3-yl]methyl-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: [2-(2-fluorophenoxy)-3-pyridyl]methyl-(1-propylpiperidin-1-ium-4-yl)ammonium CAS Name: [2-(2-fluorophenoxy)-3-pyridinyl]methyl-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [2-(2-fluorophenoxy)pyridin-3-yl]methyl-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: [2-(2-fluorophenoxy)-3-pyridyl]methyl-(1-propylpiperidin-1-ium-4-yl)ammonium Formula: C20H28FN3O+2 MolecularWeight: 345.454223

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH2+]CC2=C(N=CC=C2)OC3=CC=CC=C3F

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH2+]CC2=C(N=CC=C2)OC3=CC=CC=C3F

InChI

InChI=1S/C20H26FN3O/c1-2-12-24-13-9-17(10-14-24)23-15-16-6-5-11-22-20(16)25-19-8-4-3-7-18(19)21/h3-8,11,17,23H,2,9-10,12-15H2,1H3/p+2