(2-bromanyl-6-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (2-bromanyl-6-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (2-bromo-6-fluoro-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (2-bromo-6-fluorophenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (2-bromo-6-fluorophenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (2-bromo-6-fluoro-benzyl)-(3-pyridylmethyl)ammonium Formula: C13H13BrFN2+ MolecularWeight: 296.158123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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