1-[[3-(4-fluorophenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[[3-(4-fluorophenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-ol Openeye Name: 1-[[3-(4-fluorophenyl)-1-(p-tolyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-ol CAS Name: 1-[[3-(4-fluorophenyl)-1-(4-methylphenyl)-4-pyrazolyl]methyl]-4-piperidin-1-iumol IUPAC Name: 1-[[3-(4-fluorophenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-ol Traditional Name: 1-[[3-(4-fluorophenyl)-1-(p-tolyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-ol Formula: C22H25FN3O+ MolecularWeight: 366.451803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)C[NH+]4CCC(CC4)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)C[NH+]4CCC(CC4)O

InChI

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