1,1-dimethylpiperidin-1-ium-4-one; methyl sulfate

Systemtic Name: 1,1-dimethylpiperidin-1-ium-4-one; methyl sulfate Openeye Name: 1,1-dimethylpiperidin-1-ium-4-one; methyl sulfate CAS Name: 1,1-dimethyl-4-piperidin-1-iumone; methyl sulfate IUPAC Name: 1,1-dimethylpiperidin-1-ium-4-one; methyl sulfate Traditional Name: 1,1-dimethylpiperidin-1-ium-4-one; methyl sulfate Formula: C8H17NO5S MolecularWeight: 239.28928

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(=O)CC1)C.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1(CCC(=O)CC1)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C7H14NO.CH4O4S/c1-8(2)5-3-7(9)4-6-8;1-5-6(2,3)4/h3-6H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1