[(2R)-2,3-di(hexadecanoyloxy)propyl] 1-(trimethylazaniumyl)butan-2-yl phosphate

Systemtic Name: [(2R)-2,3-di(hexadecanoyloxy)propyl] 1-(trimethylazaniumyl)butan-2-yl phosphate Openeye Name: [(2R)-2,3-di(hexadecanoyloxy)propyl] 1-[(trimethylammonio)methyl]propyl phosphate CAS Name: [(2R)-2,3-bis(1-oxohexadecoxy)propyl] 1-(trimethylammonio)butan-2-yl phosphate IUPAC Name: [(2R)-2,3-di(hexadecanoyloxy)propyl] 1-(trimethylazaniumyl)butan-2-yl phosphate Traditional Name: [(2R)-2,3-di(hexadecanoyloxy)propyl] 1-[(trimethylammonio)methyl]propyl phosphate Formula: C42H84NO8P MolecularWeight: 762.092021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OC(CC)C[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC(CC)C[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C42H84NO8P/c1-7-10-12-14-16-18-20-22-24-26-28-30-32-34-41(44)48-37-40(38-49-52(46,47)51-39(9-3)36-43(4,5)6)50-42(45)35-33-31-29-27-25-23-21-19-17-15-13-11-8-2/h39-40H,7-38H2,1-6H3/t39?,40-/m1/s1