(2-bromanyl-5-fluoranyl-phenyl)methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (2-bromanyl-5-fluoranyl-phenyl)methyl-(pyridin-4-ylmethyl)azanium Openeye Name: (2-bromo-5-fluoro-phenyl)methyl-(4-pyridylmethyl)ammonium CAS Name: (2-bromo-5-fluorophenyl)methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (2-bromo-5-fluorophenyl)methyl-(pyridin-4-ylmethyl)azanium Traditional Name: (2-bromo-5-fluoro-benzyl)-(4-pyridylmethyl)ammonium Formula: C13H13BrFN2+ MolecularWeight: 296.158123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)C[NH2+]CC2=CC=NC=C2)Br

Isomeric SMILES

C1=CC(=C(C=C1F)C[NH2+]CC2=CC=NC=C2)Br

InChI

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