3-[(3-bromanyl-4-fluoranyl-phenyl)methoxy]pyridin-1-ium-2-amine

Systemtic Name: 3-[(3-bromanyl-4-fluoranyl-phenyl)methoxy]pyridin-1-ium-2-amine Openeye Name: 3-[(3-bromo-4-fluoro-phenyl)methoxy]pyridin-1-ium-2-amine CAS Name: 3-[(3-bromo-4-fluorophenyl)methoxy]-2-pyridin-1-iumamine IUPAC Name: 3-[(3-bromo-4-fluorophenyl)methoxy]pyridin-1-ium-2-amine Traditional Name: [3-(3-bromo-4-fluoro-benzyl)oxypyridin-1-ium-2-yl]amine Formula: C12H11BrFN2O+ MolecularWeight: 298.130943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C([NH+]=C1)N)OCC2=CC(=C(C=C2)F)Br

Isomeric SMILES

C1=CC(=C([NH+]=C1)N)OCC2=CC(=C(C=C2)F)Br

InChI

InChI=1S/C12H10BrFN2O/c13-9-6-8(3-4-10(9)14)7-17-11-2-1-5-16-12(11)15/h1-6H,7H2,(H2,15,16)/p+1