[(2R)-2-acetamido-3-octadecoxy-propyl] 2-dimethylsulfonioethyl phosphate

Systemtic Name: [(2R)-2-acetamido-3-octadecoxy-propyl] 2-dimethylsulfonioethyl phosphate Openeye Name: [(2R)-2-acetamido-3-octadecoxy-propyl] 2-dimethylsulfonioethyl phosphate CAS Name: [(2R)-2-acetamido-3-octadecoxypropyl] 2-dimethylsulfonioethyl phosphate IUPAC Name: [(2R)-2-acetamido-3-octadecoxypropyl] 2-dimethylsulfonioethyl phosphate Traditional Name: [(2R)-2-acetamido-3-stearyloxy-propyl] 2-dimethylsulfonioethyl phosphate Formula: C27H56NO6PS MolecularWeight: 553.775401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[S+](C)C)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[S+](C)C)NC(=O)C

InChI

InChI=1S/C27H56NO6PS/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32-24-27(28-26(2)29)25-34-35(30,31)33-22-23-36(3)4/h27H,5-25H2,1-4H3,(H-,28,29,30,31)/t27-/m1/s1