4-[(2-acetyloxy-3-octadecoxy-propoxy)-oxidanyl-phosphanyl]oxybutyl-trimethyl-azanium

Systemtic Name: 4-[(2-acetyloxy-3-octadecoxy-propoxy)-oxidanyl-phosphanyl]oxybutyl-trimethyl-azanium Openeye Name: 4-[(2-acetoxy-3-octadecoxy-propoxy)-hydroxy-phosphanyl]oxybutyl-trimethyl-ammonium CAS Name: 4-[(2-acetyloxy-3-octadecoxypropoxy)-hydroxyphosphino]oxybutyl-trimethylammonium IUPAC Name: 4-[(2-acetyloxy-3-octadecoxypropoxy)-hydroxyphosphanyl]oxybutyl-trimethylazanium Traditional Name: 4-[(2-acetoxy-3-stearyloxy-propoxy)-hydroxy-phosphino]oxybutyl-trimethyl-ammonium Formula: C30H63NO6P+ MolecularWeight: 564.798081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(O)OCCCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(O)OCCCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C30H63NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25-34-27-30(37-29(2)32)28-36-38(33)35-26-23-21-24-31(3,4)5/h30,33H,6-28H2,1-5H3/q+1