1-[2-[3-[(4-fluorophenyl)methyl]imidazol-3-ium-1-yl]ethyl]-3,5-dimethyl-pyrazole

Systemtic Name: 1-[2-[3-[(4-fluorophenyl)methyl]imidazol-3-ium-1-yl]ethyl]-3,5-dimethyl-pyrazole Openeye Name: 1-[2-[3-[(4-fluorophenyl)methyl]imidazol-3-ium-1-yl]ethyl]-3,5-dimethyl-pyrazole CAS Name: 1-[2-[3-[(4-fluorophenyl)methyl]-1-imidazol-3-iumyl]ethyl]-3,5-dimethylpyrazole IUPAC Name: 1-[2-[3-[(4-fluorophenyl)methyl]imidazol-3-ium-1-yl]ethyl]-3,5-dimethylpyrazole Traditional Name: 1-[2-[3-(4-fluorobenzyl)imidazol-3-ium-1-yl]ethyl]-3,5-dimethyl-pyrazole Formula: C17H20FN4+ MolecularWeight: 299.365903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCN2C=C[N+](=C2)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=NN1CCN2C=C[N+](=C2)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C17H20FN4/c1-14-11-15(2)22(19-14)10-9-20-7-8-21(13-20)12-16-3-5-17(18)6-4-16/h3-8,11,13H,9-10,12H2,1-2H3/q+1