[2-tert-butyl-4-(dimethylcarbamoyloxy)phenyl]-dimethyl-sulfanium; methyl sulfate

Systemtic Name: [2-tert-butyl-4-(dimethylcarbamoyloxy)phenyl]-dimethyl-sulfanium; methyl sulfate Openeye Name: [2-tert-butyl-4-(dimethylcarbamoyloxy)phenyl]-dimethyl-sulfonium; methyl sulfate CAS Name: [2-tert-butyl-4-[dimethylamino(oxo)methoxy]phenyl]-dimethylsulfonium; methyl sulfate IUPAC Name: [2-tert-butyl-4-(dimethylcarbamoyloxy)phenyl]-dimethylsulfanium; methyl sulfate Traditional Name: [2-tert-butyl-4-(dimethylcarbamoyloxy)phenyl]-dimethyl-sulfonium; methyl sulfate Formula: C16H27NO6S2 MolecularWeight: 393.51868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)OC(=O)N(C)C)[S+](C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)OC(=O)N(C)C)[S+](C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C15H24NO2S.CH4O4S/c1-15(2,3)12-10-11(18-14(17)16(4)5)8-9-13(12)19(6)7;1-5-6(2,3)4/h8-10H,1-7H3;1H3,(H,2,3,4)/q+1;/p-1