bis(2-hydroxyethyl)-methyl-[2-(octadecanoylamino)ethyl]azanium chloride

Systemtic Name: bis(2-hydroxyethyl)-methyl-[2-(octadecanoylamino)ethyl]azanium chloride Openeye Name: bis(2-hydroxyethyl)-methyl-[2-(octadecanoylamino)ethyl]ammonium chloride CAS Name: bis(2-hydroxyethyl)-methyl-[2-(1-oxooctadecylamino)ethyl]ammonium chloride IUPAC Name: bis(2-hydroxyethyl)-methyl-[2-(octadecanoylamino)ethyl]azanium chloride Traditional Name: bis(2-hydroxyethyl)-methyl-(2-stearamidoethyl)ammonium chloride Formula: C25H53ClN2O3 MolecularWeight: 465.15292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H52N2O3.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(30)26-19-20-27(2,21-23-28)22-24-29;/h28-29H,3-24H2,1-2H3;1H