2-[2-azanyl-3-[(4-chlorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride

Systemtic Name: 2-[2-azanyl-3-[(4-chlorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride Openeye Name: 2-[2-amino-3-[(4-chlorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride CAS Name: 2-[2-amino-3-[(4-chlorophenyl)methyl]-1-benzimidazol-3-iumyl]ethanol chloride IUPAC Name: 2-[2-amino-3-[(4-chlorophenyl)methyl]benzimidazol-3-ium-1-yl]ethanol chloride Traditional Name: 2-[2-amino-3-(4-chlorobenzyl)benzimidazol-3-ium-1-yl]ethanol chloride Formula: C16H17Cl2N3O MolecularWeight: 338.23168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=[N+]2CC3=CC=C(C=C3)Cl)N)CCO.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=[N+]2CC3=CC=C(C=C3)Cl)N)CCO.[Cl-]

InChI

InChI=1S/C16H16ClN3O.ClH/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)19(9-10-21)16(20)18;/h1-8,18,21H,9-11H2;1H