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4-dodecylbenzenesulfonate; tetrabutylazanium

4-dodecylbenzenesulfonate; tetrabutylazanium

Systemtic Name:4-dodecylbenzenesulfonate; tetrabutylazanium
Openeye Name:4-dodecylbenzenesulfonate; tetrabutylammonium
CAS Name:4-dodecylbenzenesulfonate; tetrabutylammonium
IUPAC Name:4-dodecylbenzenesulfonate; tetrabutylazanium
Traditional Name:4-laurylbesylate; tetrabutylammonium
Formula: C34H65NO3S
MolecularWeight: 567.9498
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].CCCC[N+](CCCC)(CCCC)CCCC


Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].CCCC[N+](CCCC)(CCCC)CCCC


InChI

InChI=1S/C18H30O3S.C16H36N/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h13-16H,2-12H2,1H3,(H,19,20,21);5-16H2,1-4H3/q;+1/p-1


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