3-[[2-acetyloxy-3-(4-tetradecoxyphenyl)propoxy]-oxidanyl-phosphoryl]propyl-trimethyl-azanium

Systemtic Name: 3-[[2-acetyloxy-3-(4-tetradecoxyphenyl)propoxy]-oxidanyl-phosphoryl]propyl-trimethyl-azanium Openeye Name: 3-[[2-acetoxy-3-(4-tetradecoxyphenyl)propoxy]-hydroxy-phosphoryl]propyl-trimethyl-ammonium CAS Name: 3-[[2-acetyloxy-3-(4-tetradecoxyphenyl)propoxy]-hydroxyphosphoryl]propyl-trimethylammonium IUPAC Name: 3-[[2-acetyloxy-3-(4-tetradecoxyphenyl)propoxy]-hydroxyphosphoryl]propyl-trimethylazanium Traditional Name: 3-[[2-acetoxy-3-(4-myristyloxyphenyl)propoxy]-hydroxy-phosphoryl]propyl-trimethyl-ammonium Formula: C31H57NO6P+ MolecularWeight: 570.761141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(COP(=O)(CCC[N+](C)(C)C)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(COP(=O)(CCC[N+](C)(C)C)O)OC(=O)C

InChI

InChI=1S/C31H56NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-24-36-30-21-19-29(20-22-30)26-31(38-28(2)33)27-37-39(34,35)25-18-23-32(3,4)5/h19-22,31H,6-18,23-27H2,1-5H3/p+1