ethyl sulfate; 3-(octadecanoylamino)propylazanium

Systemtic Name: ethyl sulfate; 3-(octadecanoylamino)propylazanium Openeye Name: ethyl sulfate; 3-(octadecanoylamino)propylammonium CAS Name: ethyl sulfate; 3-(1-oxooctadecylamino)propylammonium IUPAC Name: ethyl sulfate; 3-(octadecanoylamino)propylazanium Traditional Name: ethyl sulfate; 3-stearamidopropylammonium Formula: C23H50N2O5S MolecularWeight: 466.7185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCC[NH3+].CCOS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCC[NH3+].CCOS(=O)(=O)[O-]

InChI

InChI=1S/C21H44N2O.C2H6O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(24)23-20-17-19-22;1-2-6-7(3,4)5/h2-20,22H2,1H3,(H,23,24);2H2,1H3,(H,3,4,5)