(13-dodecyl-14-oxidanyl-hexacosan-13-yl)azanium chloride

Systemtic Name: (13-dodecyl-14-oxidanyl-hexacosan-13-yl)azanium chloride Openeye Name: (1,1-didodecyl-2-hydroxy-tetradecyl)ammonium chloride CAS Name: (13-dodecyl-14-hydroxyhexacosan-13-yl)ammonium chloride IUPAC Name: (13-dodecyl-14-hydroxyhexacosan-13-yl)azanium chloride Traditional Name: (2-hydroxy-1,1-dilauryl-tetradecyl)ammonium chloride Formula: C38H80ClNO MolecularWeight: 602.5009

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(CCCCCCCCCCCC)(CCCCCCCCCCCC)[NH3+])O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC(C(CCCCCCCCCCCC)(CCCCCCCCCCCC)[NH3+])O.[Cl-]

InChI

InChI=1S/C38H79NO.ClH/c1-4-7-10-13-16-19-22-25-28-31-34-37(40)38(39,35-32-29-26-23-20-17-14-11-8-5-2)36-33-30-27-24-21-18-15-12-9-6-3;/h37,40H,4-36,39H2,1-3H3;1H