[4-[2-(2-propylicosanoyloxy)ethoxy]-1-(trimethylazaniumyl)butan-2-yl] hydrogen phosphate

Systemtic Name: [4-[2-(2-propylicosanoyloxy)ethoxy]-1-(trimethylazaniumyl)butan-2-yl] hydrogen phosphate Openeye Name: [3-[2-(2-propylicosanoyloxy)ethoxy]-1-[(trimethylammonio)methyl]propyl] hydrogen phosphate CAS Name: [4-[2-(1-oxo-2-propyleicosoxy)ethoxy]-1-(trimethylammonio)butan-2-yl] hydrogen phosphate IUPAC Name: [4-[2-(2-propylicosanoyloxy)ethoxy]-1-(trimethylazaniumyl)butan-2-yl] hydrogen phosphate Traditional Name: [3-[2-(2-propyleicosanoyloxy)ethoxy]-1-[(trimethylammonio)methyl]propyl] hydrogen phosphate Formula: C32H66NO7P MolecularWeight: 607.842701

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CCC)C(=O)OCCOCCC(C[N+](C)(C)C)OP(=O)(O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CCC)C(=O)OCCOCCC(C[N+](C)(C)C)OP(=O)(O)[O-]

InChI

InChI=1S/C32H66NO7P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-30(23-7-2)32(34)39-28-27-38-26-25-31(29-33(3,4)5)40-41(35,36)37/h30-31H,6-29H2,1-5H3,(H-,35,36,37)