hydrogen sulfate; (3-methoxy-3-oxidanylidene-propyl)-dimethyl-sulfanium

Systemtic Name: hydrogen sulfate; (3-methoxy-3-oxidanylidene-propyl)-dimethyl-sulfanium Openeye Name: hydrogen sulfate; (3-methoxy-3-oxo-propyl)-dimethyl-sulfonium CAS Name: hydrogen sulfate; (3-methoxy-3-oxopropyl)-dimethylsulfonium IUPAC Name: hydrogen sulfate; (3-methoxy-3-oxopropyl)-dimethylsulfanium Traditional Name: (3-keto-3-methoxy-propyl)-dimethyl-sulfonium bisulfate Formula: C6H14O6S2 MolecularWeight: 246.30176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC[S+](C)C.OS(=O)(=O)[O-]

Isomeric SMILES

COC(=O)CC[S+](C)C.OS(=O)(=O)[O-]

InChI

InChI=1S/C6H13O2S.H2O4S/c1-8-6(7)4-5-9(2)3;1-5(2,3)4/h4-5H2,1-3H3;(H2,1,2,3,4)/q+1;/p-1