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

Systemtic Name: 1-[(2-fluorophenyl)methyl]-4-[4-(phenylmethyl)-1H-pyrazol-5-yl]piperidin-1-ium Openeye Name: 4-(4-benzyl-1H-pyrazol-5-yl)-1-[(2-fluorophenyl)methyl]piperidin-1-ium CAS Name: 1-[(2-fluorophenyl)methyl]-4-[4-(phenylmethyl)-1H-pyrazol-5-yl]piperidin-1-ium IUPAC Name: 4-(4-benzyl-1H-pyrazol-5-yl)-1-[(2-fluorophenyl)methyl]piperidin-1-ium Traditional Name: 4-(4-benzyl-1H-pyrazol-5-yl)-1-(2-fluorobenzyl)piperidin-1-ium Formula: C22H25FN3+ MolecularWeight: 350.452403

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=C(C=NN2)CC3=CC=CC=C3)CC4=CC=CC=C4F

Isomeric SMILES

C1C[NH+](CCC1C2=C(C=NN2)CC3=CC=CC=C3)CC4=CC=CC=C4F

InChI

InChI=1S/C22H24FN3/c23-21-9-5-4-8-19(21)16-26-12-10-18(11-13-26)22-20(15-24-25-22)14-17-6-2-1-3-7-17/h1-9,15,18H,10-14,16H2,(H,24,25)/p+1