2-[2-azanyl-3-[(2-fluorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride

Systemtic Name: 2-[2-azanyl-3-[(2-fluorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride Openeye Name: 2-[2-amino-3-[(2-fluorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride CAS Name: 2-[2-amino-3-[(2-fluorophenyl)methyl]-1-benzimidazol-3-iumyl]ethanol chloride IUPAC Name: 2-[2-amino-3-[(2-fluorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride Traditional Name: 2-[2-amino-3-(2-fluorobenzyl)benzimidazol-3-ium-1-yl]ethanol chloride Formula: C16H17ClFN3O MolecularWeight: 321.777083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[N+]2=C(N(C3=CC=CC=C32)CCO)N)F.[Cl-]

Isomeric SMILES

C1=CC=C(C(=C1)C[N+]2=C(N(C3=CC=CC=C32)CCO)N)F.[Cl-]

InChI

InChI=1S/C16H16FN3O.ClH/c17-13-6-2-1-5-12(13)11-20-15-8-4-3-7-14(15)19(9-10-21)16(20)18;/h1-8,18,21H,9-11H2;1H