azanium 2,3-di(hexadecanoyloxy)propyl hexadecanoate chloride

Systemtic Name: azanium 2,3-di(hexadecanoyloxy)propyl hexadecanoate chloride Openeye Name: ammonium 2,3-di(hexadecanoyloxy)propyl hexadecanoate chloride CAS Name: ammonium hexadecanoic acid 2,3-bis(1-oxohexadecoxy)propyl ester chloride IUPAC Name: azanium 2,3-di(hexadecanoyloxy)propyl hexadecanoate chloride Traditional Name: ammonium palmitic acid 2,3-di(hexadecanoyloxy)propyl ester chloride Formula: C51H102ClNO6 MolecularWeight: 860.81168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC.[NH4+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC.[NH4+].[Cl-]

InChI

InChI=1S/C51H98O6.ClH.H3N/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-49(52)55-46-48(57-51(54)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2;;/h48H,4-47H2,1-3H3;1H;1H3