2-[(2-acetamido-3-octadecoxy-propoxy)-oxidanyl-phosphoryl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-acetamido-3-octadecoxy-propoxy)-oxidanyl-phosphoryl]ethyl-dimethyl-azanium Openeye Name: 2-[(2-acetamido-3-octadecoxy-propoxy)-hydroxy-phosphoryl]ethyl-dimethyl-ammonium CAS Name: 2-[(2-acetamido-3-octadecoxypropoxy)-hydroxyphosphoryl]ethyl-dimethylammonium IUPAC Name: 2-[(2-acetamido-3-octadecoxypropoxy)-hydroxyphosphoryl]ethyl-dimethylazanium Traditional Name: 2-[(2-acetamido-3-stearyloxy-propoxy)-hydroxy-phosphoryl]ethyl-dimethyl-ammonium Formula: C27H58N2O5P+ MolecularWeight: 521.733581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(CC[NH+](C)C)O)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(CC[NH+](C)C)O)NC(=O)C

InChI

InChI=1S/C27H57N2O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-33-24-27(28-26(2)30)25-34-35(31,32)23-21-29(3)4/h27H,5-25H2,1-4H3,(H,28,30)(H,31,32)/p+1