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2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylethyl-hexadecyl-dimethyl-azanium

2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylethyl-hexadecyl-dimethyl-azanium

Systemtic Name:2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylethyl-hexadecyl-dimethyl-azanium
Openeye Name:2-(2-amino-2-oxo-ethyl)sulfanylethyl-hexadecyl-dimethyl-ammonium
CAS Name:2-[(2-amino-2-oxoethyl)thio]ethyl-hexadecyl-dimethylammonium
IUPAC Name:2-(2-amino-2-oxoethyl)sulfanylethyl-hexadecyl-dimethylazanium
Traditional Name:2-[(2-amino-2-keto-ethyl)thio]ethyl-cetyl-dimethyl-ammonium
Formula: C22H47N2OS+
MolecularWeight: 387.68638
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCSCC(=O)N


Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCSCC(=O)N


InChI

InChI=1S/C22H46N2OS/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(2,3)19-20-26-21-22(23)25/h4-21H2,1-3H3,(H-,23,25)/p+1


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