diethyl-[(E)-octadec-1-enyl]-octadecyl-azanium chloride

Systemtic Name: diethyl-[(E)-octadec-1-enyl]-octadecyl-azanium chloride Openeye Name: diethyl-[(E)-octadec-1-enyl]-octadecyl-ammonium chloride CAS Name: diethyl-[(E)-octadec-1-enyl]-octadecylammonium chloride IUPAC Name: diethyl-[(E)-octadec-1-enyl]-octadecylazanium chloride Traditional Name: diethyl-[(E)-octadec-1-enyl]-stearyl-ammonium chloride Formula: C40H82ClN MolecularWeight: 612.53878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CC)(CC)C=CCCCCCCCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CC)(CC)/C=C/CCCCCCCCCCCCCCCC.[Cl-]

InChI

InChI=1S/C40H82N.ClH/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41(7-3,8-4)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2;/h37,39H,5-36,38,40H2,1-4H3;1H/q+1;/p-1/b39-37+;