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

Systemtic Name: 2-ethyl-3-[(4-fluorophenyl)methyl]-1H-benzimidazol-3-ium Openeye Name: 2-ethyl-3-[(4-fluorophenyl)methyl]-1H-benzimidazol-3-ium CAS Name: 2-ethyl-3-[(4-fluorophenyl)methyl]-1H-benzimidazol-3-ium IUPAC Name: 2-ethyl-3-[(4-fluorophenyl)methyl]-1H-benzimidazol-3-ium Traditional Name: 2-ethyl-3-(4-fluorobenzyl)-1H-benzimidazol-3-ium Formula: C16H16FN2+ MolecularWeight: 255.310043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)F

InChI

InChI=1S/C16H15FN2/c1-2-16-18-14-5-3-4-6-15(14)19(16)11-12-7-9-13(17)10-8-12/h3-10H,2,11H2,1H3/p+1