1-(2-azanyl-3-hexyl-benzimidazol-1-ium-1-yl)-3-[2,4-bis(chloranyl)phenoxy]propan-2-ol

Systemtic Name: 1-(2-azanyl-3-hexyl-benzimidazol-1-ium-1-yl)-3-[2,4-bis(chloranyl)phenoxy]propan-2-ol Openeye Name: 1-(2-amino-3-hexyl-benzimidazol-1-ium-1-yl)-3-(2,4-dichlorophenoxy)propan-2-ol CAS Name: 1-(2-amino-3-hexyl-1-benzimidazol-1-iumyl)-3-(2,4-dichlorophenoxy)-2-propanol IUPAC Name: 1-(2-amino-3-hexylbenzimidazol-1-ium-1-yl)-3-(2,4-dichlorophenoxy)propan-2-ol Traditional Name: 1-(2-amino-3-hexyl-benzimidazol-1-ium-1-yl)-3-(2,4-dichlorophenoxy)propan-2-ol Formula: C22H28Cl2N3O2+ MolecularWeight: 437.38262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2[N+](=C1N)CC(COC3=C(C=C(C=C3)Cl)Cl)O

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2[N+](=C1N)CC(COC3=C(C=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C22H27Cl2N3O2/c1-2-3-4-7-12-26-19-8-5-6-9-20(19)27(22(26)25)14-17(28)15-29-21-11-10-16(23)13-18(21)24/h5-6,8-11,13,17,25,28H,2-4,7,12,14-15H2,1H3/p+1