(3-bromanyl-4-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (3-bromo-4-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=CC(=C(C=C2)F)Br

Isomeric SMILES

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

InChI

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