2-[[4-hexadecanoyloxy-2-(5-oxidanylidenepentanoyloxy)butoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[4-hexadecanoyloxy-2-(5-oxidanylidenepentanoyloxy)butoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[4-hexadecanoyloxy-2-(5-oxopentanoyloxy)butoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-(1,5-dioxopentoxy)-4-(1-oxohexadecoxy)butoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[4-hexadecanoyloxy-2-(5-oxopentanoyloxy)butoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[4-hexadecanoyloxy-2-(5-ketopentanoyloxy)butoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C30H59NO9P+ MolecularWeight: 608.764521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCC=O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCC=O

InChI

InChI=1S/C30H58NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29(33)37-25-22-28(40-30(34)21-18-19-24-32)27-39-41(35,36)38-26-23-31(2,3)4/h24,28H,5-23,25-27H2,1-4H3/p+1