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

Systemtic Name: 3-(4-methoxy-6-methyl-pyrimidin-2-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one Openeye Name: 3-(4-methoxy-6-methyl-pyrimidin-2-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one CAS Name: 3-[(4-methoxy-6-methyl-2-pyrimidinyl)oxy]-1-propyl-3H-pyridazin-1-ium-6-one IUPAC Name: 3-(4-methoxy-6-methylpyrimidin-2-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one Traditional Name: 3-(4-methoxy-6-methyl-pyrimidin-2-yl)oxy-1-propyl-3H-pyridazin-1-ium-6-one Formula: C13H17N4O3+ MolecularWeight: 277.29908

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=NC(C=CC1=O)OC2=NC(=CC(=N2)OC)C

Isomeric SMILES

CCC[N+]1=NC(C=CC1=O)OC2=NC(=CC(=N2)OC)C

InChI

InChI=1S/C13H17N4O3/c1-4-7-17-12(18)6-5-10(16-17)20-13-14-9(2)8-11(15-13)19-3/h5-6,8,10H,4,7H2,1-3H3/q+1