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tetraheptylazanium sulfate

tetraheptylazanium sulfate

Systemtic Name:tetraheptylazanium sulfate
Openeye Name:tetraheptylammonium sulfate
CAS Name:tetraheptylammonium sulfate
IUPAC Name:tetraheptylazanium sulfate
Traditional Name:tetraheptylammonium sulfate
Formula: C56H120N2O4S
MolecularWeight: 917.628
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[O-]S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[O-]S(=O)(=O)[O-]


InChI

InChI=1S/2C28H60N.H2O4S/c2*1-5-9-13-17-21-25-29(26-22-18-14-10-6-2,27-23-19-15-11-7-3)28-24-20-16-12-8-4;1-5(2,3)4/h2*5-28H2,1-4H3;(H2,1,2,3,4)/q2*+1;/p-2


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