3-[1-[[1-(2-fluorophenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]-1-morpholin-4-yl-propan-1-one

Systemtic Name: 3-[1-[[1-(2-fluorophenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]-1-morpholin-4-yl-propan-1-one Openeye Name: 3-[1-[[1-(2-fluorophenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]-1-morpholino-propan-1-one CAS Name: 3-[1-[[1-(2-fluorophenyl)-4-pyrazolyl]methyl]-4-piperidin-1-iumyl]-1-(4-morpholinyl)-1-propanone IUPAC Name: 3-[1-[[1-(2-fluorophenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]-1-morpholin-4-ylpropan-1-one Traditional Name: 3-[1-[[1-(2-fluorophenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]-1-morpholino-propan-1-one Formula: C22H30FN4O2+ MolecularWeight: 401.497603

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=CN(N=C3)C4=CC=CC=C4F

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=CN(N=C3)C4=CC=CC=C4F

InChI

InChI=1S/C22H29FN4O2/c23-20-3-1-2-4-21(20)27-17-19(15-24-27)16-25-9-7-18(8-10-25)5-6-22(28)26-11-13-29-14-12-26/h1-4,15,17-18H,5-14,16H2/p+1