(2-azanyl-6-methyl-4-morpholin-4-yl-pyrimidin-1-ium-1-yl) hydrogen sulfate hydroxide

Systemtic Name: (2-azanyl-6-methyl-4-morpholin-4-yl-pyrimidin-1-ium-1-yl) hydrogen sulfate hydroxide Openeye Name: (2-amino-6-methyl-4-morpholino-pyrimidin-1-ium-1-yl) hydrogen sulfate hydroxide CAS Name: sulfuric acid [2-amino-6-methyl-4-(4-morpholinyl)-1-pyrimidin-1-iumyl] ester hydroxide IUPAC Name: (2-amino-6-methyl-4-morpholin-4-ylpyrimidin-1-ium-1-yl) hydrogen sulfate hydroxide Traditional Name: sulfuric acid (2-amino-6-methyl-4-morpholino-pyrimidin-1-ium-1-yl) ester hydroxide Formula: C9H16N4O6S MolecularWeight: 308.31154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=[N+]1OS(=O)(=O)O)N)N2CCOCC2.[OH-]

Isomeric SMILES

CC1=CC(=NC(=[N+]1OS(=O)(=O)O)N)N2CCOCC2.[OH-]

InChI

InChI=1S/C9H14N4O5S.H2O/c1-7-6-8(12-2-4-17-5-3-12)11-9(10)13(7)18-19(14,15)16;/h6,10H,2-5H2,1H3,(H,14,15,16);1H2