2-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol chloride

Systemtic Name: 2-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol chloride Openeye Name: 2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol chloride CAS Name: 2-(2-amino-3-butyl-1-benzimidazol-1-iumyl)-1-(4-chlorophenyl)ethanol chloride IUPAC Name: 2-(2-amino-3-butylbenzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol chloride Traditional Name: 2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol chloride Formula: C19H23Cl2N3O MolecularWeight: 380.31142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(C3=CC=C(C=C3)Cl)O.[Cl-]

Isomeric SMILES

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(C3=CC=C(C=C3)Cl)O.[Cl-]

InChI

InChI=1S/C19H22ClN3O.ClH/c1-2-3-12-22-16-6-4-5-7-17(16)23(19(22)21)13-18(24)14-8-10-15(20)11-9-14;/h4-11,18,21,24H,2-3,12-13H2,1H3;1H