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

Systemtic Name: 1,5-di(hexadecanoyloxy)pentan-3-yl-(2-hydroxyethyl)azanium Openeye Name: [3-hexadecanoyloxy-1-(2-hexadecanoyloxyethyl)propyl]-(2-hydroxyethyl)ammonium CAS Name: 1,5-bis(1-oxohexadecoxy)pentan-3-yl-(2-hydroxyethyl)ammonium IUPAC Name: 1,5-di(hexadecanoyloxy)pentan-3-yl-(2-hydroxyethyl)azanium Traditional Name: [3-hexadecanoyloxy-1-(2-hexadecanoyloxyethyl)propyl]-(2-hydroxyethyl)ammonium Formula: C39H78NO5+ MolecularWeight: 641.04032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCCC(CCOC(=O)CCCCCCCCCCCCCCC)[NH2+]CCO

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCCC(CCOC(=O)CCCCCCCCCCCCCCC)[NH2+]CCO

InChI

InChI=1S/C39H77NO5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-38(42)44-35-31-37(40-33-34-41)32-36-45-39(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37,40-41H,3-36H2,1-2H3/p+1