(5-bromanyl-2-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (5-bromo-2-fluoro-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (5-bromo-2-fluorophenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (5-bromo-2-fluorophenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (5-bromo-2-fluoro-benzyl)-(3-pyridylmethyl)ammonium Formula: C13H13BrFN2+ MolecularWeight: 296.158123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrFN2/c14-12-3-4-13(15)11(6-12)9-17-8-10-2-1-5-16-7-10/h1-7,17H,8-9H2/p+1