1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyphenyl)piperidin-1-ium

Systemtic Name: 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyphenyl)piperidin-1-ium Openeye Name: 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyphenyl)piperidin-1-ium CAS Name: 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyphenyl)piperidin-1-ium IUPAC Name: 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyphenyl)piperidin-1-ium Traditional Name: 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyphenyl)piperidin-1-ium Formula: C22H25FN3O+ MolecularWeight: 366.451803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1C2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O/c1-27-21-5-3-2-4-20(21)16-10-12-26(13-11-16)15-18-14-24-25-22(18)17-6-8-19(23)9-7-17/h2-9,14,16H,10-13,15H2,1H3,(H,24,25)/p+1