5-chloranyl-2,6-bis(3-methylimidazol-3-ium-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 5-chloranyl-2,6-bis(3-methylimidazol-3-ium-1-yl)-1H-pyrimidin-4-one Openeye Name: 5-chloro-2,6-bis(3-methylimidazol-3-ium-1-yl)-1H-pyrimidin-4-one CAS Name: 5-chloro-2,6-bis(3-methyl-1-imidazol-3-iumyl)-1H-pyrimidin-4-one IUPAC Name: 5-chloro-2,6-bis(3-methylimidazol-3-ium-1-yl)-1H-pyrimidin-4-one Traditional Name: 5-chloro-2,6-bis(3-methylimidazol-3-ium-1-yl)-1H-pyrimidin-4-one Formula: C12H13ClN6O+2 MolecularWeight: 292.72422

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C2=C(C(=O)N=C(N2)N3C=C[N+](=C3)C)Cl

Isomeric SMILES

C[N+]1=CN(C=C1)C2=C(C(=O)N=C(N2)N3C=C[N+](=C3)C)Cl

InChI

InChI=1S/C12H12ClN6O/c1-16-3-5-18(7-16)10-9(13)11(20)15-12(14-10)19-6-4-17(2)8-19/h3-8H,1-2H3/q+1/p+1