(3-bromanyl-4-fluoranyl-phenyl)methyl-[3-(furan-2-ylmethoxy)propyl]azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-[3-(furan-2-ylmethoxy)propyl]azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-[3-(2-furylmethoxy)propyl]ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-[3-(2-furanylmethoxy)propyl]ammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-[3-(furan-2-ylmethoxy)propyl]azanium Traditional Name: (3-bromo-4-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=CC(=C(C=C2)F)Br

Isomeric SMILES

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

InChI

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