(3-dodecoxy-2-oxidanyl-propyl)-trimethyl-azanium; methyl sulfate

Systemtic Name: (3-dodecoxy-2-oxidanyl-propyl)-trimethyl-azanium; methyl sulfate Openeye Name: (3-dodecoxy-2-hydroxy-propyl)-trimethyl-ammonium; methyl sulfate CAS Name: (3-dodecoxy-2-hydroxypropyl)-trimethylammonium; methyl sulfate IUPAC Name: (3-dodecoxy-2-hydroxypropyl)-trimethylazanium; methyl sulfate Traditional Name: (2-hydroxy-3-lauryloxy-propyl)-trimethyl-ammonium; methyl sulfate Formula: C19H43NO6S MolecularWeight: 413.61282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC(C[N+](C)(C)C)O.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOCC(C[N+](C)(C)C)O.COS(=O)(=O)[O-]

InChI

InChI=1S/C18H40NO2.CH4O4S/c1-5-6-7-8-9-10-11-12-13-14-15-21-17-18(20)16-19(2,3)4;1-5-6(2,3)4/h18,20H,5-17H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1