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

Systemtic Name: 1-(2-azanyl-3-pentyl-benzimidazol-1-ium-1-yl)-3-[2,4-bis(chloranyl)phenoxy]propan-2-ol Openeye Name: 1-(2-amino-3-pentyl-benzimidazol-1-ium-1-yl)-3-(2,4-dichlorophenoxy)propan-2-ol CAS Name: 1-(2-amino-3-pentyl-1-benzimidazol-1-iumyl)-3-(2,4-dichlorophenoxy)-2-propanol IUPAC Name: 1-(2-amino-3-pentylbenzimidazol-1-ium-1-yl)-3-(2,4-dichlorophenoxy)propan-2-ol Traditional Name: 1-(2-amino-3-amyl-benzimidazol-1-ium-1-yl)-3-(2,4-dichlorophenoxy)propan-2-ol Formula: C21H26Cl2N3O2+ MolecularWeight: 423.35604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2[N+](=C1N)CC(COC3=C(C=C(C=C3)Cl)Cl)O

Isomeric SMILES

CCCCCN1C2=CC=CC=C2[N+](=C1N)CC(COC3=C(C=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C21H25Cl2N3O2/c1-2-3-6-11-25-18-7-4-5-8-19(18)26(21(25)24)13-16(27)14-28-20-10-9-15(22)12-17(20)23/h4-5,7-10,12,16,24,27H,2-3,6,11,13-14H2,1H3/p+1