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8-[dimethyl(3-sulfopropyl)azaniumyl]octyl-dodecyl-dimethyl-azanium

8-[dimethyl(3-sulfopropyl)azaniumyl]octyl-dodecyl-dimethyl-azanium

Systemtic Name:8-[dimethyl(3-sulfopropyl)azaniumyl]octyl-dodecyl-dimethyl-azanium
Openeye Name:8-[dimethyl(3-sulfopropyl)ammonio]octyl-dodecyl-dimethyl-ammonium
CAS Name:8-[dimethyl(3-sulfopropyl)ammonio]octyl-dodecyl-dimethylammonium
IUPAC Name:8-[dimethyl(3-sulfopropyl)azaniumyl]octyl-dodecyl-dimethylazanium
Traditional Name:8-[dimethyl(3-sulfopropyl)ammonio]octyl-lauryl-dimethyl-ammonium
Formula: C27H60N2O3S+2
MolecularWeight: 492.8419
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CCCCCCCC[N+](C)(C)CCCS(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CCCCCCCC[N+](C)(C)CCCS(=O)(=O)O


InChI

InChI=1S/C27H59N2O3S/c1-6-7-8-9-10-11-12-13-16-19-23-28(2,3)24-20-17-14-15-18-21-25-29(4,5)26-22-27-33(30,31)32/h6-27H2,1-5H3/q+1/p+1


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