(1-dodecoxy-2-oxidanyl-nonadecan-4-yl)-dimethyl-azanium chloride

Systemtic Name: (1-dodecoxy-2-oxidanyl-nonadecan-4-yl)-dimethyl-azanium chloride Openeye Name: 1-(3-dodecoxy-2-hydroxy-propyl)hexadecyl-dimethyl-ammonium chloride CAS Name: (1-dodecoxy-2-hydroxynonadecan-4-yl)-dimethylammonium chloride IUPAC Name: (1-dodecoxy-2-hydroxynonadecan-4-yl)-dimethylazanium chloride Traditional Name: 1-(2-hydroxy-3-lauryloxy-propyl)hexadecyl-dimethyl-ammonium chloride Formula: C33H70ClNO2 MolecularWeight: 548.3674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC(COCCCCCCCCCCCC)O)[NH+](C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC(COCCCCCCCCCCCC)O)[NH+](C)C.[Cl-]

InChI

InChI=1S/C33H69NO2.ClH/c1-5-7-9-11-13-15-17-18-19-20-22-24-26-28-32(34(3)4)30-33(35)31-36-29-27-25-23-21-16-14-12-10-8-6-2;/h32-33,35H,5-31H2,1-4H3;1H