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benzenesulfonate; ethyl(trihexyl)azanium

benzenesulfonate; ethyl(trihexyl)azanium

Systemtic Name:benzenesulfonate; ethyl(trihexyl)azanium
Openeye Name:benzenesulfonate; ethyl(trihexyl)ammonium
CAS Name:benzenesulfonate; ethyl(trihexyl)ammonium
IUPAC Name:benzenesulfonate; ethyl(trihexyl)azanium
Traditional Name:ethyl(trihexyl)ammonium besylate
Formula: C26H49NO3S
MolecularWeight: 455.73716
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C20H44N.C6H6O3S/c1-5-9-12-15-18-21(8-4,19-16-13-10-6-2)20-17-14-11-7-3;7-10(8,9)6-4-2-1-3-5-6/h5-20H2,1-4H3;1-5H,(H,7,8,9)/q+1;/p-1


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