2-[[3-(2-hexadecylphenoxy)-2-methanoyloxy-propoxy]-oxidanyl-phosphanyl]oxyethyl-dimethyl-azanium

Systemtic Name: 2-[[3-(2-hexadecylphenoxy)-2-methanoyloxy-propoxy]-oxidanyl-phosphanyl]oxyethyl-dimethyl-azanium Openeye Name: 2-[[2-formyloxy-3-(2-hexadecylphenoxy)propoxy]-hydroxy-phosphanyl]oxyethyl-dimethyl-ammonium CAS Name: 2-[[2-formyloxy-3-(2-hexadecylphenoxy)propoxy]-hydroxyphosphino]oxyethyl-dimethylammonium IUPAC Name: 2-[[2-formyloxy-3-(2-hexadecylphenoxy)propoxy]-hydroxyphosphanyl]oxyethyl-dimethylazanium Traditional Name: 2-[[3-(2-cetylphenoxy)-2-formyloxy-propoxy]-hydroxy-phosphino]oxyethyl-dimethyl-ammonium Formula: C30H55NO6P+ MolecularWeight: 556.734561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCC[NH+](C)C)OC=O

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCC[NH+](C)C)OC=O

InChI

InChI=1S/C30H54NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-21-18-19-22-30(28)34-25-29(35-27-32)26-37-38(33)36-24-23-31(2)3/h18-19,21-22,27,29,33H,4-17,20,23-26H2,1-3H3/p+1