[(2R)-4-diethoxyphosphoryl-4,4-bis(fluoranyl)-2-[(E)-octadec-9-enoyl]oxy-butyl] (E)-octadec-9-enoate

Systemtic Name: [(2R)-4-diethoxyphosphoryl-4,4-bis(fluoranyl)-2-[(E)-octadec-9-enoyl]oxy-butyl] (E)-octadec-9-enoate Openeye Name: [(2R)-4-diethoxyphosphoryl-4,4-difluoro-2-[(E)-octadec-9-enoyl]oxy-butyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [(2R)-4-diethoxyphosphoryl-4,4-difluoro-2-[(E)-1-oxooctadec-9-enoxy]butyl] ester IUPAC Name: [(2R)-4-diethoxyphosphoryl-4,4-difluoro-2-[(E)-octadec-9-enoyl]oxybutyl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [(2R)-4-diethoxyphosphoryl-4,4-difluoro-2-[(E)-octadec-9-enoyl]oxy-butyl] ester Formula: C44H81F2O7P MolecularWeight: 791.080307

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(CC(F)(F)P(=O)(OCC)OCC)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@@H](CC(F)(F)P(=O)(OCC)OCC)OC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C44H81F2O7P/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(47)50-40-41(39-44(45,46)54(49,51-7-3)52-8-4)53-43(48)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h21-24,41H,5-20,25-40H2,1-4H3/b23-21+,24-22+/t41-/m1/s1