dimethyl-[[4-(methylsulfonylamino)phenyl]methyl]-prop-2-ynyl-azanium bromide

Systemtic Name: dimethyl-[[4-(methylsulfonylamino)phenyl]methyl]-prop-2-ynyl-azanium bromide Openeye Name: [4-(methanesulfonamido)phenyl]methyl-dimethyl-prop-2-ynyl-ammonium bromide CAS Name: [4-(methanesulfonamido)phenyl]methyl-dimethyl-prop-2-ynylammonium bromide IUPAC Name: [4-(methanesulfonamido)phenyl]methyl-dimethyl-prop-2-ynylazanium bromide Traditional Name: [4-(methanesulfonamido)benzyl]-dimethyl-propargyl-ammonium bromide Formula: C13H19BrN2O2S MolecularWeight: 347.27116

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC#C)CC1=CC=C(C=C1)NS(=O)(=O)C.[Br-]

Isomeric SMILES

C[N+](C)(CC#C)CC1=CC=C(C=C1)NS(=O)(=O)C.[Br-]

InChI

InChI=1S/C13H19N2O2S.BrH/c1-5-10-15(2,3)11-12-6-8-13(9-7-12)14-18(4,16)17;/h1,6-9,14H,10-11H2,2-4H3;1H/q+1;/p-1