6-(1-methylpiperidin-1-ium-4-yl)-2-(2-morpholin-4-ylpyridin-1-ium-3-yl)-1H-pyrimidin-4-one

Systemtic Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(2-morpholin-4-ylpyridin-1-ium-3-yl)-1H-pyrimidin-4-one Openeye Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(2-morpholinopyridin-1-ium-3-yl)-1H-pyrimidin-4-one CAS Name: 6-(1-methyl-4-piperidin-1-iumyl)-2-[2-(4-morpholinyl)-3-pyridin-1-iumyl]-1H-pyrimidin-4-one IUPAC Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(2-morpholin-4-ylpyridin-1-ium-3-yl)-1H-pyrimidin-4-one Traditional Name: 6-(1-methylpiperidin-1-ium-4-yl)-2-(2-morpholinopyridin-1-ium-3-yl)-1H-pyrimidin-4-one Formula: C19H27N5O2+2 MolecularWeight: 357.44998

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)C2=CC(=O)N=C(N2)C3=C([NH+]=CC=C3)N4CCOCC4

Isomeric SMILES

C[NH+]1CCC(CC1)C2=CC(=O)N=C(N2)C3=C([NH+]=CC=C3)N4CCOCC4

InChI

InChI=1S/C19H25N5O2/c1-23-7-4-14(5-8-23)16-13-17(25)22-18(21-16)15-3-2-6-20-19(15)24-9-11-26-12-10-24/h2-3,6,13-14H,4-5,7-12H2,1H3,(H,21,22,25)/p+2