(1-butan-2-yloxy-2,6-dimethyl-pyrimidin-1-ium-4-yl) hydrogen sulfate

Systemtic Name: (1-butan-2-yloxy-2,6-dimethyl-pyrimidin-1-ium-4-yl) hydrogen sulfate Openeye Name: (2,6-dimethyl-1-sec-butoxy-pyrimidin-1-ium-4-yl) hydrogen sulfate CAS Name: sulfuric acid (1-butan-2-yloxy-2,6-dimethyl-4-pyrimidin-1-iumyl) ester IUPAC Name: (1-butan-2-yloxy-2,6-dimethylpyrimidin-1-ium-4-yl) hydrogen sulfate Traditional Name: sulfuric acid (2,6-dimethyl-1-sec-butoxy-pyrimidin-1-ium-4-yl) ester Formula: C10H17N2O5S+ MolecularWeight: 277.31738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)O[N+]1=C(N=C(C=C1C)OS(=O)(=O)O)C

Isomeric SMILES

CCC(C)O[N+]1=C(N=C(C=C1C)OS(=O)(=O)O)C

InChI

InChI=1S/C10H16N2O5S/c1-5-8(3)16-12-7(2)6-10(11-9(12)4)17-18(13,14)15/h6,8H,5H2,1-4H3/p+1