2-hydroxyethyl-methyl-[(Z)-octadec-9-enyl]-octadecyl-azanium chloride

Systemtic Name: 2-hydroxyethyl-methyl-[(Z)-octadec-9-enyl]-octadecyl-azanium chloride Openeye Name: 2-hydroxyethyl-methyl-[(Z)-octadec-9-enyl]-octadecyl-ammonium chloride CAS Name: 2-hydroxyethyl-methyl-[(Z)-octadec-9-enyl]-octadecylammonium chloride IUPAC Name: 2-hydroxyethyl-methyl-[(Z)-octadec-9-enyl]-octadecylazanium chloride Traditional Name: 2-hydroxyethyl-methyl-[(Z)-octadec-9-enyl]-stearyl-ammonium chloride Formula: C39H80ClNO MolecularWeight: 614.5116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCC=CCCCCCCCC)CCO.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCC/C=C\CCCCCCCC)CCO.[Cl-]

InChI

InChI=1S/C39H80NO.ClH/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-40(3,38-39-41)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;/h18,20,41H,4-17,19,21-39H2,1-3H3;1H/q+1;/p-1/b20-18-;