(5-bromanyl-2-fluoranyl-phenyl)methyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]azanium

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)methyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]azanium Openeye Name: (5-bromo-2-fluoro-phenyl)methyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ammonium CAS Name: (5-bromo-2-fluorophenyl)methyl-[3-(4-methyl-1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: (5-bromo-2-fluorophenyl)methyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]azanium Traditional Name: (5-bromo-2-fluoro-benzyl)-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ammonium Formula: C16H26BrFN2+2 MolecularWeight: 345.293443

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCC[NH2+]CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC1CC[NH+](CC1)CCC[NH2+]CC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C16H24BrFN2/c1-13-5-9-20(10-6-13)8-2-7-19-12-14-11-15(17)3-4-16(14)18/h3-4,11,13,19H,2,5-10,12H2,1H3/p+2