[1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium

Systemtic Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium Openeye Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)ammonium CAS Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)-4-pyrazolyl]methyl-[3-(1-pyrazolyl)propyl]ammonium IUPAC Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)azanium Traditional Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-(3-pyrazol-1-ylpropyl)ammonium Formula: C23H25FN5O+ MolecularWeight: 406.475903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCCN3C=CC=N3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCCN3C=CC=N3)C4=CC=CC=C4F

InChI

InChI=1S/C23H24FN5O/c1-30-20-10-8-18(9-11-20)23-19(16-25-12-4-14-28-15-5-13-26-28)17-29(27-23)22-7-3-2-6-21(22)24/h2-3,5-11,13,15,17,25H,4,12,14,16H2,1H3/p+1