1-ethyl-3-[2-(4-fluoranylphenoxy)ethyl]benzimidazol-3-ium-2-amine bromide

Systemtic Name: 1-ethyl-3-[2-(4-fluoranylphenoxy)ethyl]benzimidazol-3-ium-2-amine bromide Openeye Name: 1-ethyl-3-[2-(4-fluorophenoxy)ethyl]benzimidazol-3-ium-2-amine bromide CAS Name: 1-ethyl-3-[2-(4-fluorophenoxy)ethyl]-2-benzimidazol-3-iumamine bromide IUPAC Name: 1-ethyl-3-[2-(4-fluorophenoxy)ethyl]benzimidazol-3-ium-2-amine bromide Traditional Name: [1-ethyl-3-[2-(4-fluorophenoxy)ethyl]benzimidazol-3-ium-2-yl]amine bromide Formula: C17H19BrFN3O MolecularWeight: 380.254663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2[N+](=C1N)CCOC3=CC=C(C=C3)F.[Br-]

Isomeric SMILES

CCN1C2=CC=CC=C2[N+](=C1N)CCOC3=CC=C(C=C3)F.[Br-]

InChI

InChI=1S/C17H18FN3O.BrH/c1-2-20-15-5-3-4-6-16(15)21(17(20)19)11-12-22-14-9-7-13(18)8-10-14;/h3-10,19H,2,11-12H2,1H3;1H