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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(=O)(CCC[N+](C)(C)C)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(=O)(CCC[N+](C)(C)C)O)OC(=O)C

InChI

InChI=1S/C31H56NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-21-29-22-18-19-23-31(29)36-26-30(38-28(2)33)27-37-39(34,35)25-20-24-32(3,4)5/h18-19,22-23,30H,6-17,20-21,24-27H2,1-5H3/p+1