lithium [(2R)-2-decanoylsulfanyl-3-[(E)-3-phenylprop-2-enoxy]propyl] methyl phosphate

Systemtic Name: lithium [(2R)-2-decanoylsulfanyl-3-[(E)-3-phenylprop-2-enoxy]propyl] methyl phosphate Openeye Name: lithium [(2R)-3-[(E)-cinnamyl]oxy-2-decanoylsulfanyl-propyl] methyl phosphate CAS Name: lithium methyl [(2R)-2-(1-oxodecylthio)-3-[(E)-3-phenylprop-2-enoxy]propyl] phosphate IUPAC Name: lithium [(2R)-2-decanoylsulfanyl-3-[(E)-3-phenylprop-2-enoxy]propyl] methyl phosphate Traditional Name: lithium [(2R)-2-(caprylthio)-3-[(E)-cinnamyl]oxy-propyl] methyl phosphate Formula: C23H36LiO6PS MolecularWeight: 478.508101

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCCCCCCCCC(=O)SC(COCC=CC1=CC=CC=C1)COP(=O)([O-])OC

Isomeric SMILES

[Li+].CCCCCCCCCC(=O)S[C@H](COC/C=C/C1=CC=CC=C1)COP(=O)([O-])OC

InChI

InChI=1S/C23H37O6PS.Li/c1-3-4-5-6-7-8-12-17-23(24)31-22(20-29-30(25,26)27-2)19-28-18-13-16-21-14-10-9-11-15-21;/h9-11,13-16,22H,3-8,12,17-20H2,1-2H3,(H,25,26);/q;+1/p-1/b16-13+;/t22-;/m1./s1