[(2R)-1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(2R)-1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [(1R)-2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl]-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [(1R)-2-(2-fluoroanilino)-2-keto-1-methyl-ethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C16H26FN3O+2 MolecularWeight: 295.395543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1F)[NH+](C)C2CC[NH+](CC2)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1F)[NH+](C)C2CC[NH+](CC2)C

InChI

InChI=1S/C16H24FN3O/c1-12(20(3)13-8-10-19(2)11-9-13)16(21)18-15-7-5-4-6-14(15)17/h4-7,12-13H,8-11H2,1-3H3,(H,18,21)/p+2/t12-/m1/s1