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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)F

InChI

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