3-[[3-(trifluoromethyl)phenyl]methoxy]pyridin-1-ium-2-amine

Systemtic Name: 3-[[3-(trifluoromethyl)phenyl]methoxy]pyridin-1-ium-2-amine Openeye Name: 3-[[3-(trifluoromethyl)phenyl]methoxy]pyridin-1-ium-2-amine CAS Name: 3-[[3-(trifluoromethyl)phenyl]methoxy]-2-pyridin-1-iumamine IUPAC Name: 3-[[3-(trifluoromethyl)phenyl]methoxy]pyridin-1-ium-2-amine Traditional Name: [3-[3-(trifluoromethyl)benzyl]oxypyridin-1-ium-2-yl]amine Formula: C13H12F3N2O+ MolecularWeight: 269.24239

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)COC2=C([NH+]=CC=C2)N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)COC2=C([NH+]=CC=C2)N

InChI

InChI=1S/C13H11F3N2O/c14-13(15,16)10-4-1-3-9(7-10)8-19-11-5-2-6-18-12(11)17/h1-7H,8H2,(H2,17,18)/p+1