propane-1-sulfonate; trioctylazanium

Systemtic Name: propane-1-sulfonate; trioctylazanium Openeye Name: propane-1-sulfonate; trioctylammonium CAS Name: 1-propanesulfonate; trioctylammonium IUPAC Name: propane-1-sulfonate; trioctylazanium Traditional Name: propane-1-sulfonate; trioctylammonium Formula: C27H59NO3S MolecularWeight: 477.82726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[NH+](CCCCCCCC)CCCCCCCC.CCCS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCC[NH+](CCCCCCCC)CCCCCCCC.CCCS(=O)(=O)[O-]

InChI

InChI=1S/C24H51N.C3H8O3S/c1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3;1-2-3-7(4,5)6/h4-24H2,1-3H3;2-3H2,1H3,(H,4,5,6)