[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(2-methylpropyl)azanium

Systemtic Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(2-methylpropyl)azanium Openeye Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-isobutyl-ammonium CAS Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(2-methylpropyl)ammonium IUPAC Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(2-methylpropyl)azanium Traditional Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-isobutyl-ammonium Formula: C14H19FN3+ MolecularWeight: 248.319163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC1=C(NN=C1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)C[NH2+]CC1=C(NN=C1)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H18FN3/c1-10(2)7-16-8-12-9-17-18-14(12)11-3-5-13(15)6-4-11/h3-6,9-10,16H,7-8H2,1-2H3,(H,17,18)/p+1