triethyl-[4-[3-methyl-4-(methylsulfonylamino)phenyl]butyl]azanium bromide

Systemtic Name: triethyl-[4-[3-methyl-4-(methylsulfonylamino)phenyl]butyl]azanium bromide Openeye Name: triethyl-[4-[4-(methanesulfonamido)-3-methyl-phenyl]butyl]ammonium bromide CAS Name: triethyl-[4-[4-(methanesulfonamido)-3-methylphenyl]butyl]ammonium bromide IUPAC Name: triethyl-[4-[4-(methanesulfonamido)-3-methylphenyl]butyl]azanium bromide Traditional Name: triethyl-[4-[4-(methanesulfonamido)-3-methyl-phenyl]butyl]ammonium bromide Formula: C18H33BrN2O2S MolecularWeight: 421.43582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCCCC1=CC(=C(C=C1)NS(=O)(=O)C)C.[Br-]

Isomeric SMILES

CC[N+](CC)(CC)CCCCC1=CC(=C(C=C1)NS(=O)(=O)C)C.[Br-]

InChI

InChI=1S/C18H33N2O2S.BrH/c1-6-20(7-2,8-3)14-10-9-11-17-12-13-18(16(4)15-17)19-23(5,21)22;/h12-13,15,19H,6-11,14H2,1-5H3;1H/q+1;/p-1