1-[1-(2-azanyl-4-fluoranyl-phenoxy)-4-ethynyl-piperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-[1-(2-azanyl-4-fluoranyl-phenoxy)-4-ethynyl-piperidin-1-ium-1-yl]ethanone Openeye Name: 1-[1-(2-amino-4-fluoro-phenoxy)-4-ethynyl-piperidin-1-ium-1-yl]ethanone CAS Name: 1-[1-(2-amino-4-fluorophenoxy)-4-ethynyl-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-[1-(2-amino-4-fluorophenoxy)-4-ethynylpiperidin-1-ium-1-yl]ethanone Traditional Name: 1-[1-(2-amino-4-fluoro-phenoxy)-4-ethynyl-piperidin-1-ium-1-yl]ethanone Formula: C15H18FN2O2+ MolecularWeight: 277.314023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+]1(CCC(CC1)C#C)OC2=C(C=C(C=C2)F)N

Isomeric SMILES

CC(=O)[N+]1(CCC(CC1)C#C)OC2=C(C=C(C=C2)F)N

InChI

InChI=1S/C15H18FN2O2/c1-3-12-6-8-18(9-7-12,11(2)19)20-15-5-4-13(16)10-14(15)17/h1,4-5,10,12H,6-9,17H2,2H3/q+1