[(2R)-2-decanoyloxy-3-[(E)-12-naphthalen-2-yldodec-11-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2R)-2-decanoyloxy-3-[(E)-12-naphthalen-2-yldodec-11-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2R)-2-decanoyloxy-3-[(E)-12-(2-naphthyl)dodec-11-enoxy]propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2R)-3-[(E)-12-(2-naphthalenyl)dodec-11-enoxy]-2-(1-oxodecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2R)-2-decanoyloxy-3-[(E)-12-naphthalen-2-yldodec-11-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2R)-2-capryloxy-3-[(E)-12-(2-naphthyl)dodec-11-enoxy]propyl] 2-(trimethylammonio)ethyl phosphate Formula: C40H66NO7P MolecularWeight: 703.928301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC(COCCCCCCCCCCC=CC1=CC2=CC=CC=C2C=C1)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCC(=O)O[C@H](COCCCCCCCCCC/C=C/C1=CC2=CC=CC=C2C=C1)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C40H66NO7P/c1-5-6-7-8-13-17-20-27-40(42)48-39(35-47-49(43,44)46-32-30-41(2,3)4)34-45-31-23-18-15-12-10-9-11-14-16-19-24-36-28-29-37-25-21-22-26-38(37)33-36/h19,21-22,24-26,28-29,33,39H,5-18,20,23,27,30-32,34-35H2,1-4H3/b24-19+/t39-/m1/s1