[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(phenylmethyl)azanium

Systemtic Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: benzyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C17H17FN3+ MolecularWeight: 282.335383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]CC2=C(NN=C2)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]CC2=C(NN=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H16FN3/c18-16-8-6-14(7-9-16)17-15(12-20-21-17)11-19-10-13-4-2-1-3-5-13/h1-9,12,19H,10-11H2,(H,20,21)/p+1