2-[(2-acetyloxy-3-hexadecoxy-3-methyl-butoxy)-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[(2-acetyloxy-3-hexadecoxy-3-methyl-butoxy)-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium Openeye Name: 2-[(2-acetoxy-3-hexadecoxy-3-methyl-butoxy)-hydroxy-phosphanyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[(2-acetyloxy-3-hexadecoxy-3-methylbutoxy)-hydroxyphosphino]oxyethyl-trimethylammonium IUPAC Name: 2-[(2-acetyloxy-3-hexadecoxy-3-methylbutoxy)-hydroxyphosphanyl]oxyethyl-trimethylazanium Traditional Name: 2-[(2-acetoxy-3-cetyloxy-3-methyl-butoxy)-hydroxy-phosphino]oxyethyl-trimethyl-ammonium Formula: C28H59NO6P+ MolecularWeight: 536.744921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(C)(C)C(COP(O)OCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(C)(C)C(COP(O)OCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C28H59NO6P/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-32-28(3,4)27(35-26(2)30)25-34-36(31)33-24-22-29(5,6)7/h27,31H,8-25H2,1-7H3/q+1