1,5-di(octadecanoyloxy)pentan-3-yl-(2-hydroxyethyl)azanium

Systemtic Name: 1,5-di(octadecanoyloxy)pentan-3-yl-(2-hydroxyethyl)azanium Openeye Name: 2-hydroxyethyl-[3-octadecanoyloxy-1-(2-octadecanoyloxyethyl)propyl]ammonium CAS Name: 1,5-bis(1-oxooctadecoxy)pentan-3-yl-(2-hydroxyethyl)ammonium IUPAC Name: 1,5-di(octadecanoyloxy)pentan-3-yl-(2-hydroxyethyl)azanium Traditional Name: 2-hydroxyethyl-[3-stearoyloxy-1-(2-stearoyloxyethyl)propyl]ammonium Formula: C43H86NO5+ MolecularWeight: 697.14664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCC(CCOC(=O)CCCCCCCCCCCCCCCCC)[NH2+]CCO

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCC(CCOC(=O)CCCCCCCCCCCCCCCCC)[NH2+]CCO

InChI

InChI=1S/C43H85NO5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(46)48-39-35-41(44-37-38-45)36-40-49-43(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h41,44-45H,3-40H2,1-2H3/p+1