2-[(3-acetyloxy-4-hexadecoxy-butan-2-yl)oxy-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[(3-acetyloxy-4-hexadecoxy-butan-2-yl)oxy-oxidanyl-phosphanyl]oxyethyl-trimethyl-azanium Openeye Name: 2-[(2-acetoxy-3-hexadecoxy-1-methyl-propoxy)-hydroxy-phosphanyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[(3-acetyloxy-4-hexadecoxybutan-2-yl)oxy-hydroxyphosphino]oxyethyl-trimethylammonium IUPAC Name: 2-[(3-acetyloxy-4-hexadecoxybutan-2-yl)oxy-hydroxyphosphanyl]oxyethyl-trimethylazanium Traditional Name: 2-[(2-acetoxy-3-cetyloxy-1-methyl-propoxy)-hydroxy-phosphino]oxyethyl-trimethyl-ammonium Formula: C27H57NO6P+ MolecularWeight: 522.718341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(C(C)OP(O)OCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(C(C)OP(O)OCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C27H57NO6P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-27(33-26(3)29)25(2)34-35(30)32-23-21-28(4,5)6/h25,27,30H,7-24H2,1-6H3/q+1