[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(3-imidazol-1-ylpropyl)ammonium Formula: C16H19FN5+ MolecularWeight: 300.353963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=NN2)C[NH2+]CCCN3C=CN=C3)F

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=NN2)C[NH2+]CCCN3C=CN=C3)F

InChI

InChI=1S/C16H18FN5/c17-15-4-2-13(3-5-15)16-14(11-20-21-16)10-18-6-1-8-22-9-7-19-12-22/h2-5,7,9,11-12,18H,1,6,8,10H2,(H,20,21)/p+1