5-fluoranyl-6-methyl-2-[2-[[4-(pyridin-4-ylmethyl)piperidin-1-ium-1-yl]methyl]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 5-fluoranyl-6-methyl-2-[2-[[4-(pyridin-4-ylmethyl)piperidin-1-ium-1-yl]methyl]phenyl]-1H-pyrimidin-4-one Openeye Name: 5-fluoro-6-methyl-2-[2-[[4-(4-pyridylmethyl)piperidin-1-ium-1-yl]methyl]phenyl]-1H-pyrimidin-4-one CAS Name: 5-fluoro-6-methyl-2-[2-[[4-(pyridin-4-ylmethyl)-1-piperidin-1-iumyl]methyl]phenyl]-1H-pyrimidin-4-one IUPAC Name: 5-fluoro-6-methyl-2-[2-[[4-(pyridin-4-ylmethyl)piperidin-1-ium-1-yl]methyl]phenyl]-1H-pyrimidin-4-one Traditional Name: 5-fluoro-6-methyl-2-[2-[[4-(4-pyridylmethyl)piperidin-1-ium-1-yl]methyl]phenyl]-1H-pyrimidin-4-one Formula: C23H26FN4O+ MolecularWeight: 393.477143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC=CC=C2C[NH+]3CCC(CC3)CC4=CC=NC=C4)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC=CC=C2C[NH+]3CCC(CC3)CC4=CC=NC=C4)F

InChI

InChI=1S/C23H25FN4O/c1-16-21(24)23(29)27-22(26-16)20-5-3-2-4-19(20)15-28-12-8-18(9-13-28)14-17-6-10-25-11-7-17/h2-7,10-11,18H,8-9,12-15H2,1H3,(H,26,27,29)/p+1