[2-[(E)-octadec-9-enoyl]oxy-3-[oxidanyl-[2-[2,2,2-tris(fluoranyl)ethanoylamino]ethoxy]phosphoryl]oxy-propyl] (E)-octadec-9-enoate

Systemtic Name: [2-[(E)-octadec-9-enoyl]oxy-3-[oxidanyl-[2-[2,2,2-tris(fluoranyl)ethanoylamino]ethoxy]phosphoryl]oxy-propyl] (E)-octadec-9-enoate Openeye Name: [3-[hydroxy-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]phosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxy-propyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [3-[hydroxy-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]ethoxy]phosphoryl]oxy-2-[(E)-1-oxooctadec-9-enoxy]propyl] ester IUPAC Name: [3-[hydroxy-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]phosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [3-[hydroxy-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]phosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxy-propyl] ester Formula: C43H77F3NO9P MolecularWeight: 840.041751

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)C(F)(F)F)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)C(F)(F)F)OC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C43H77F3NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(48)53-37-39(38-55-57(51,52)54-36-35-47-42(50)43(44,45)46)56-41(49)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,39H,3-16,21-38H2,1-2H3,(H,47,50)(H,51,52)/b19-17+,20-18+