3-(2-chloranyl-6-methyl-pyrimidin-4-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one

Systemtic Name: 3-(2-chloranyl-6-methyl-pyrimidin-4-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one Openeye Name: 3-(2-chloro-6-methyl-pyrimidin-4-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one CAS Name: 3-[(2-chloro-6-methyl-4-pyrimidinyl)oxy]-1-propyl-3H-pyridazin-1-ium-6-one IUPAC Name: 3-(2-chloro-6-methylpyrimidin-4-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one Traditional Name: 3-(2-chloro-6-methyl-pyrimidin-4-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one Formula: C12H14ClN4O2+ MolecularWeight: 281.71816

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=NC(C=CC1=O)OC2=NC(=NC(=C2)C)Cl

Isomeric SMILES

CCC[N+]1=NC(C=CC1=O)OC2=NC(=NC(=C2)C)Cl

InChI

InChI=1S/C12H14ClN4O2/c1-3-6-17-11(18)5-4-9(16-17)19-10-7-8(2)14-12(13)15-10/h4-5,7,9H,3,6H2,1-2H3/q+1