5,6-bis[(E)-octadec-9-enoxy]hexyl-trimethyl-azanium chloride

Systemtic Name: 5,6-bis[(E)-octadec-9-enoxy]hexyl-trimethyl-azanium chloride Openeye Name: 5,6-bis[(E)-octadec-9-enoxy]hexyl-trimethyl-ammonium chloride CAS Name: 5,6-bis[(E)-octadec-9-enoxy]hexyl-trimethylammonium chloride IUPAC Name: 5,6-bis[(E)-octadec-9-enoxy]hexyl-trimethylazanium chloride Traditional Name: 5,6-bis[(E)-octadec-9-enoxy]hexyl-trimethyl-ammonium chloride Formula: C45H90ClNO2 MolecularWeight: 712.6546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(CCCC[N+](C)(C)C)OCCCCCCCCC=CCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(CCCC[N+](C)(C)C)OCCCCCCCC/C=C/CCCCCCCC.[Cl-]

InChI

InChI=1S/C45H90NO2.ClH/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38-42-47-44-45(40-36-37-41-46(3,4)5)48-43-39-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2;/h20-23,45H,6-19,24-44H2,1-5H3;1H/q+1;/p-1/b22-20+,23-21+;