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

Systemtic Name: 2-(2-azanyl-3-propyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol Openeye Name: 2-(2-amino-3-propyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol CAS Name: 2-(2-amino-3-propyl-1-benzimidazol-1-iumyl)-1-(4-chlorophenyl)ethanol IUPAC Name: 2-(2-amino-3-propylbenzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol Traditional Name: 2-(2-amino-3-propyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol Formula: C18H21ClN3O+ MolecularWeight: 330.83184

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2[N+](=C1N)CC(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCCN1C2=CC=CC=C2[N+](=C1N)CC(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C18H20ClN3O/c1-2-11-21-15-5-3-4-6-16(15)22(18(21)20)12-17(23)13-7-9-14(19)10-8-13/h3-10,17,20,23H,2,11-12H2,1H3/p+1