[3-(dimethylcarbamoylsulfanyl)phenyl]-trimethyl-azanium; methyl sulfate

Systemtic Name: [3-(dimethylcarbamoylsulfanyl)phenyl]-trimethyl-azanium; methyl sulfate Openeye Name: [3-(dimethylcarbamoylsulfanyl)phenyl]-trimethyl-ammonium; methyl sulfate CAS Name: [3-[[dimethylamino(oxo)methyl]thio]phenyl]-trimethylammonium; methyl sulfate IUPAC Name: [3-(dimethylcarbamoylsulfanyl)phenyl]-trimethylazanium; methyl sulfate Traditional Name: [3-(dimethylcarbamoylthio)phenyl]-trimethyl-ammonium; methyl sulfate Formula: C13H22N2O5S2 MolecularWeight: 350.45418

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CN(C)C(=O)SC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C12H19N2OS.CH4O4S/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;1-5-6(2,3)4/h6-9H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1