N-(2-fluoranyl-4-methyl-phenyl)-2-(4-phenylmethoxypiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-fluoranyl-4-methyl-phenyl)-2-(4-phenylmethoxypiperidin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-benzyloxypiperidin-1-ium-1-yl)-N-(2-fluoro-4-methyl-phenyl)acetamide CAS Name: N-(2-fluoro-4-methylphenyl)-2-(4-phenylmethoxy-1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2-fluoro-4-methylphenyl)-2-(4-phenylmethoxypiperidin-1-ium-1-yl)acetamide Traditional Name: 2-(4-benzoxypiperidin-1-ium-1-yl)-N-(2-fluoro-4-methyl-phenyl)acetamide Formula: C21H26FN2O2+ MolecularWeight: 357.441743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(CC2)OCC3=CC=CC=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(CC2)OCC3=CC=CC=C3)F

InChI

InChI=1S/C21H25FN2O2/c1-16-7-8-20(19(22)13-16)23-21(25)14-24-11-9-18(10-12-24)26-15-17-5-3-2-4-6-17/h2-8,13,18H,9-12,14-15H2,1H3,(H,23,25)/p+1