[4-bromanyl-3-(dimethylcarbamoyloxy)phenyl]-trimethyl-azanium; methyl sulfate

Systemtic Name: [4-bromanyl-3-(dimethylcarbamoyloxy)phenyl]-trimethyl-azanium; methyl sulfate Openeye Name: [4-bromo-3-(dimethylcarbamoyloxy)phenyl]-trimethyl-ammonium; methyl sulfate CAS Name: [4-bromo-3-[dimethylamino(oxo)methoxy]phenyl]-trimethylammonium; methyl sulfate IUPAC Name: [4-bromo-3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium; methyl sulfate Traditional Name: [4-bromo-3-(dimethylcarbamoyloxy)phenyl]-trimethyl-ammonium; methyl sulfate Formula: C13H21BrN2O6S MolecularWeight: 413.28464

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=C(C=CC(=C1)[N+](C)(C)C)Br.COS(=O)(=O)[O-]

Isomeric SMILES

CN(C)C(=O)OC1=C(C=CC(=C1)[N+](C)(C)C)Br.COS(=O)(=O)[O-]

InChI

InChI=1S/C12H18BrN2O2.CH4O4S/c1-14(2)12(16)17-11-8-9(15(3,4)5)6-7-10(11)13;1-5-6(2,3)4/h6-8H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1