6-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Openeye Name: 6-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]-1H-pyrimidin-4-one CAS Name: 6-[1-(4-dibenzofuranylmethyl)-4-piperidin-1-iumyl]-1H-pyrimidin-4-one IUPAC Name: 6-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Traditional Name: 6-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Formula: C22H22N3O2+ MolecularWeight: 360.42898

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CC(=O)N=CN2)CC3=CC=CC4=C3OC5=CC=CC=C45

Isomeric SMILES

C1C[NH+](CCC1C2=CC(=O)N=CN2)CC3=CC=CC4=C3OC5=CC=CC=C45

InChI

InChI=1S/C22H21N3O2/c26-21-12-19(23-14-24-21)15-8-10-25(11-9-15)13-16-4-3-6-18-17-5-1-2-7-20(17)27-22(16)18/h1-7,12,14-15H,8-11,13H2,(H,23,24,26)/p+1