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

Systemtic Name: 2-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)-1-(4-bromophenyl)ethanol Openeye Name: 2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)-1-(4-bromophenyl)ethanol CAS Name: 2-(2-amino-3-butyl-1-benzimidazol-1-iumyl)-1-(4-bromophenyl)ethanol IUPAC Name: 2-(2-amino-3-butylbenzimidazol-1-ium-1-yl)-1-(4-bromophenyl)ethanol Traditional Name: 2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)-1-(4-bromophenyl)ethanol Formula: C19H23BrN3O+ MolecularWeight: 389.30942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(C3=CC=C(C=C3)Br)O

Isomeric SMILES

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C19H22BrN3O/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/p+1