(5-bromanyl-2-fluoranyl-phenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Openeye Name: (5-bromo-2-fluoro-phenyl)methyl-(1-isopropylpiperidin-1-ium-4-yl)ammonium CAS Name: (5-bromo-2-fluorophenyl)methyl-(1-propan-2-yl-4-piperidin-1-iumyl)ammonium IUPAC Name: (5-bromo-2-fluorophenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Traditional Name: (5-bromo-2-fluoro-benzyl)-(1-isopropylpiperidin-1-ium-4-yl)ammonium Formula: C15H24BrFN2+2 MolecularWeight: 331.266863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C15H22BrFN2/c1-11(2)19-7-5-14(6-8-19)18-10-12-9-13(16)3-4-15(12)17/h3-4,9,11,14,18H,5-8,10H2,1-2H3/p+2