trimethyl-[[4-(phenylsulfonyl)phenyl]methyl]azanium bromide

Systemtic Name: trimethyl-[[4-(phenylsulfonyl)phenyl]methyl]azanium bromide Openeye Name: [4-(benzenesulfonyl)phenyl]methyl-trimethyl-ammonium bromide CAS Name: [4-(benzenesulfonyl)phenyl]methyl-trimethylammonium bromide IUPAC Name: [4-(benzenesulfonyl)phenyl]methyl-trimethylazanium bromide Traditional Name: (4-besylbenzyl)-trimethyl-ammonium bromide Formula: C16H20BrNO2S MolecularWeight: 370.3045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

C[N+](C)(C)CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C16H20NO2S.BrH/c1-17(2,3)13-14-9-11-16(12-10-14)20(18,19)15-7-5-4-6-8-15;/h4-12H,13H2,1-3H3;1H/q+1;/p-1