carboxymethyl-dodecyl-diethyl-azanium; ethyl hydrogen sulfate

Systemtic Name: carboxymethyl-dodecyl-diethyl-azanium; ethyl hydrogen sulfate Openeye Name: carboxymethyl-dodecyl-diethyl-ammonium; ethyl hydrogen sulfate CAS Name: carboxymethyl-dodecyl-diethylammonium; sulfuric acid ethyl ester IUPAC Name: carboxymethyl-dodecyl-diethylazanium; ethyl hydrogen sulfate Traditional Name: carboxymethyl-diethyl-lauryl-ammonium; sulfuric acid ethyl ester Formula: C20H44NO6S+ MolecularWeight: 426.63146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](CC)(CC)CC(=O)O.CCOS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCC[N+](CC)(CC)CC(=O)O.CCOS(=O)(=O)O

InChI

InChI=1S/C18H37NO2.C2H6O4S/c1-4-7-8-9-10-11-12-13-14-15-16-19(5-2,6-3)17-18(20)21;1-2-6-7(3,4)5/h4-17H2,1-3H3;2H2,1H3,(H,3,4,5)/p+1