3-[(4-fluorophenyl)methyl]-2-propyl-1H-benzimidazol-3-ium

Systemtic Name: 3-[(4-fluorophenyl)methyl]-2-propyl-1H-benzimidazol-3-ium Openeye Name: 3-[(4-fluorophenyl)methyl]-2-propyl-1H-benzimidazol-3-ium CAS Name: 3-[(4-fluorophenyl)methyl]-2-propyl-1H-benzimidazol-3-ium IUPAC Name: 3-[(4-fluorophenyl)methyl]-2-propyl-1H-benzimidazol-3-ium Traditional Name: 3-(4-fluorobenzyl)-2-propyl-1H-benzimidazol-3-ium Formula: C17H18FN2+ MolecularWeight: 269.336623

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN2/c1-2-5-17-19-15-6-3-4-7-16(15)20(17)12-13-8-10-14(18)11-9-13/h3-4,6-11H,2,5,12H2,1H3/p+1