2-[2,3-bis[[(Z)-icos-9-enoyl]oxy]propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2,3-bis[[(Z)-icos-9-enoyl]oxy]propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2,3-bis[[(Z)-icos-9-enoyl]oxy]propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2,3-bis[(Z)-1-oxoeicos-9-enoxy]propoxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[2,3-bis[[(Z)-icos-9-enoyl]oxy]propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[2,3-bis[[(Z)-eicos-9-enoyl]oxy]propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C48H93NO8P+ MolecularWeight: 843.227681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCC/C=C\CCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCCCC

InChI

InChI=1S/C48H92NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h24-27,46H,6-23,28-45H2,1-5H3/p+1/b26-24-,27-25-