[(2R)-1-[(5-bromanyl-2-fluoranyl-phenyl)methyl]piperidin-1-ium-2-yl]methylazanium

Systemtic Name: [(2R)-1-[(5-bromanyl-2-fluoranyl-phenyl)methyl]piperidin-1-ium-2-yl]methylazanium Openeye Name: [(2R)-1-[(5-bromo-2-fluoro-phenyl)methyl]piperidin-1-ium-2-yl]methylammonium CAS Name: [(2R)-1-[(5-bromo-2-fluorophenyl)methyl]-2-piperidin-1-iumyl]methylammonium IUPAC Name: [(2R)-1-[(5-bromo-2-fluorophenyl)methyl]piperidin-1-ium-2-yl]methylazanium Traditional Name: [(2R)-1-(5-bromo-2-fluoro-benzyl)piperidin-1-ium-2-yl]methylammonium Formula: C13H20BrFN2+2 MolecularWeight: 303.213703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C[NH3+])CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1CC[NH+]([C@H](C1)C[NH3+])CC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C13H18BrFN2/c14-11-4-5-13(15)10(7-11)9-17-6-2-1-3-12(17)8-16/h4-5,7,12H,1-3,6,8-9,16H2/p+2/t12-/m1/s1