(5-bromanyl-2-fluoranyl-phenyl)methyl-[3-(furan-2-ylmethoxy)propyl]azanium

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)methyl-[3-(furan-2-ylmethoxy)propyl]azanium Openeye Name: (5-bromo-2-fluoro-phenyl)methyl-[3-(2-furylmethoxy)propyl]ammonium CAS Name: (5-bromo-2-fluorophenyl)methyl-[3-(2-furanylmethoxy)propyl]ammonium IUPAC Name: (5-bromo-2-fluorophenyl)methyl-[3-(furan-2-ylmethoxy)propyl]azanium Traditional Name: (5-bromo-2-fluoro-benzyl)-[3-(2-furfuryloxy)propyl]ammonium Formula: C15H18BrFNO2+ MolecularWeight: 343.211323

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)COCCC[NH2+]CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1=COC(=C1)COCCC[NH2+]CC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C15H17BrFNO2/c16-13-4-5-15(17)12(9-13)10-18-6-2-7-19-11-14-3-1-8-20-14/h1,3-5,8-9,18H,2,6-7,10-11H2/p+1