(3-bromanyl-4-fluoranyl-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: (3-bromo-4-fluoro-benzyl)-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C14H22BrFN2+2 MolecularWeight: 317.240283

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC2=CC(=C(C=C2)F)Br

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC2=CC(=C(C=C2)F)Br

InChI

InChI=1S/C14H20BrFN2/c1-17-7-5-12(6-8-17)18(2)10-11-3-4-14(16)13(15)9-11/h3-4,9,12H,5-8,10H2,1-2H3/p+2