[5-(2-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-(2-pyrazol-1-ylethyl)azanium

Systemtic Name: [5-(2-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-(2-pyrazol-1-ylethyl)azanium Openeye Name: [5-(2-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-(2-pyrazol-1-ylethyl)ammonium CAS Name: [5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl-[2-(1-pyrazolyl)ethyl]ammonium IUPAC Name: [5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl-(2-pyrazol-1-ylethyl)azanium Traditional Name: [5-(2-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-(2-pyrazol-1-ylethyl)ammonium Formula: C16H19FN5O+ MolecularWeight: 316.353363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C(C=NN2)C[NH2+]CCN3C=CC=N3)F

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C(C=NN2)C[NH2+]CCN3C=CC=N3)F

InChI

InChI=1S/C16H18FN5O/c1-23-13-3-4-14(15(17)9-13)16-12(11-19-21-16)10-18-6-8-22-7-2-5-20-22/h2-5,7,9,11,18H,6,8,10H2,1H3,(H,19,21)/p+1