(3-hexadecanoyloxy-2-tetradecanoyloxy-propyl) 1-(trimethylazaniumyl)butan-2-yl phosphate

Systemtic Name: (3-hexadecanoyloxy-2-tetradecanoyloxy-propyl) 1-(trimethylazaniumyl)butan-2-yl phosphate Openeye Name: (3-hexadecanoyloxy-2-tetradecanoyloxy-propyl) 1-[(trimethylammonio)methyl]propyl phosphate CAS Name: [3-(1-oxohexadecoxy)-2-(1-oxotetradecoxy)propyl] 1-(trimethylammonio)butan-2-yl phosphate IUPAC Name: (3-hexadecanoyloxy-2-tetradecanoyloxypropyl) 1-(trimethylazaniumyl)butan-2-yl phosphate Traditional Name: (3-hexadecanoyloxy-2-tetradecanoyloxy-propyl) 1-[(trimethylammonio)methyl]propyl phosphate Formula: C40H80NO8P MolecularWeight: 734.038861

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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)CCCCCCCCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C40H80NO8P/c1-7-10-12-14-16-18-20-21-23-24-26-28-30-32-39(42)46-35-38(36-47-50(44,45)49-37(9-3)34-41(4,5)6)48-40(43)33-31-29-27-25-22-19-17-15-13-11-8-2/h37-38H,7-36H2,1-6H3