decyl-dimethyl-[3-(11-sulfanylundecanoylamino)propyl]azanium chloride

Systemtic Name: decyl-dimethyl-[3-(11-sulfanylundecanoylamino)propyl]azanium chloride Openeye Name: decyl-dimethyl-[3-(11-sulfanylundecanoylamino)propyl]ammonium chloride CAS Name: decyl-[3-[(11-mercapto-1-oxoundecyl)amino]propyl]-dimethylammonium chloride IUPAC Name: decyl-dimethyl-[3-(11-sulfanylundecanoylamino)propyl]azanium chloride Traditional Name: decyl-[3-(11-mercaptoundecanoylamino)propyl]-dimethyl-ammonium chloride Formula: C26H55ClN2OS MolecularWeight: 479.2457

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+](C)(C)CCCNC(=O)CCCCCCCCCCS.[Cl-]

Isomeric SMILES

CCCCCCCCCC[N+](C)(C)CCCNC(=O)CCCCCCCCCCS.[Cl-]

InChI

InChI=1S/C26H54N2OS.ClH/c1-4-5-6-7-8-12-15-18-23-28(2,3)24-20-22-27-26(29)21-17-14-11-9-10-13-16-19-25-30;/h4-25H2,1-3H3,(H-,27,29,30);1H