diethyl-heptyl-[3-[4-(methylsulfonylamino)phenyl]propyl]azanium bromide

Systemtic Name: diethyl-heptyl-[3-[4-(methylsulfonylamino)phenyl]propyl]azanium bromide Openeye Name: diethyl-heptyl-[3-[4-(methanesulfonamido)phenyl]propyl]ammonium bromide CAS Name: diethyl-heptyl-[3-[4-(methanesulfonamido)phenyl]propyl]ammonium bromide IUPAC Name: diethyl-heptyl-[3-[4-(methanesulfonamido)phenyl]propyl]azanium bromide Traditional Name: diethyl-heptyl-[3-[4-(methanesulfonamido)phenyl]propyl]ammonium bromide Formula: C21H39BrN2O2S MolecularWeight: 463.51556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+](CC)(CC)CCCC1=CC=C(C=C1)NS(=O)(=O)C.[Br-]

Isomeric SMILES

CCCCCCC[N+](CC)(CC)CCCC1=CC=C(C=C1)NS(=O)(=O)C.[Br-]

InChI

InChI=1S/C21H39N2O2S.BrH/c1-5-8-9-10-11-18-23(6-2,7-3)19-12-13-20-14-16-21(17-15-20)22-26(4,24)25;/h14-17,22H,5-13,18-19H2,1-4H3;1H/q+1;/p-1