6-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one Openeye Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one CAS Name: 6-(4-methoxyphenyl)-2-(4-methyl-1-piperazin-4-iumyl)-1H-pyrimidin-4-one IUPAC Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one Traditional Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=O)C=C(N2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=O)C=C(N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H20N4O2/c1-19-7-9-20(10-8-19)16-17-14(11-15(21)18-16)12-3-5-13(22-2)6-4-12/h3-6,11H,7-10H2,1-2H3,(H,17,18,21)/p+1