2-[[2-acetyloxy-3-(4-tetradecylphenoxy)propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-acetyloxy-3-(4-tetradecylphenoxy)propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-acetoxy-3-(4-tetradecylphenoxy)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-acetyloxy-3-(4-tetradecylphenoxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-acetyloxy-3-(4-tetradecylphenoxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[2-acetoxy-3-(4-myristylphenoxy)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C30H55NO7P+ MolecularWeight: 572.733961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C30H54NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-28-19-21-29(22-20-28)35-25-30(38-27(2)32)26-37-39(33,34)36-24-23-31(3,4)5/h19-22,30H,6-18,23-26H2,1-5H3/p+1