decyl-[3-(11-ethanoylsulfanylundecanoylamino)propyl]-dimethyl-azanium bromide

Systemtic Name: decyl-[3-(11-ethanoylsulfanylundecanoylamino)propyl]-dimethyl-azanium bromide Openeye Name: 3-(11-acetylsulfanylundecanoylamino)propyl-decyl-dimethyl-ammonium bromide CAS Name: 3-[[11-(acetylthio)-1-oxoundecyl]amino]propyl-decyl-dimethylammonium bromide IUPAC Name: 3-(11-acetylsulfanylundecanoylamino)propyl-decyl-dimethylazanium bromide Traditional Name: 3-[11-(acetylthio)undecanoylamino]propyl-decyl-dimethyl-ammonium bromide Formula: C28H57BrN2O2S MolecularWeight: 565.73338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+](C)(C)CCCNC(=O)CCCCCCCCCCSC(=O)C.[Br-]

Isomeric SMILES

CCCCCCCCCC[N+](C)(C)CCCNC(=O)CCCCCCCCCCSC(=O)C.[Br-]

InChI

InChI=1S/C28H56N2O2S.BrH/c1-5-6-7-8-9-13-16-19-24-30(3,4)25-21-23-29-28(32)22-18-15-12-10-11-14-17-20-26-33-27(2)31;/h5-26H2,1-4H3;1H