2-[(5-bromanylpyridin-1-ium-2-yl)amino]-1-phenyl-ethanol chloride

Systemtic Name: 2-[(5-bromanylpyridin-1-ium-2-yl)amino]-1-phenyl-ethanol chloride Openeye Name: 2-[(5-bromopyridin-1-ium-2-yl)amino]-1-phenyl-ethanol chloride CAS Name: 2-[(5-bromo-2-pyridin-1-iumyl)amino]-1-phenylethanol chloride IUPAC Name: 2-[(5-bromopyridin-1-ium-2-yl)amino]-1-phenylethanol chloride Traditional Name: 2-[(5-bromopyridin-1-ium-2-yl)amino]-1-phenyl-ethanol chloride Formula: C13H14BrClN2O MolecularWeight: 329.62006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC2=[NH+]C=C(C=C2)Br)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(CNC2=[NH+]C=C(C=C2)Br)O.[Cl-]

InChI

InChI=1S/C13H13BrN2O.ClH/c14-11-6-7-13(15-8-11)16-9-12(17)10-4-2-1-3-5-10;/h1-8,12,17H,9H2,(H,15,16);1H