[4-(diethylcarbamoyloxy)-2,5-dimethyl-phenyl]-dimethyl-sulfanium; methyl sulfate

Systemtic Name: [4-(diethylcarbamoyloxy)-2,5-dimethyl-phenyl]-dimethyl-sulfanium; methyl sulfate Openeye Name: [4-(diethylcarbamoyloxy)-2,5-dimethyl-phenyl]-dimethyl-sulfonium; methyl sulfate CAS Name: [4-[diethylamino(oxo)methoxy]-2,5-dimethylphenyl]-dimethylsulfonium; methyl sulfate IUPAC Name: [4-(diethylcarbamoyloxy)-2,5-dimethylphenyl]-dimethylsulfanium; methyl sulfate Traditional Name: [4-(diethylcarbamoyloxy)-2,5-dimethyl-phenyl]-dimethyl-sulfonium; methyl sulfate Formula: C16H27NO6S2 MolecularWeight: 393.51868

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)OC1=C(C=C(C(=C1)C)[S+](C)C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)OC1=C(C=C(C(=C1)C)[S+](C)C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C15H24NO2S.CH4O4S/c1-7-16(8-2)15(17)18-13-9-12(4)14(19(5)6)10-11(13)3;1-5-6(2,3)4/h9-10H,7-8H2,1-6H3;1H3,(H,2,3,4)/q+1;/p-1