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

Systemtic Name: 2-[[2-methanoyloxy-3-(3-tridecylphenoxy)propoxy]-oxidanyl-phosphanyl]oxyethyl-dimethyl-azanium Openeye Name: 2-[[2-formyloxy-3-(3-tridecylphenoxy)propoxy]-hydroxy-phosphanyl]oxyethyl-dimethyl-ammonium CAS Name: 2-[[2-formyloxy-3-(3-tridecylphenoxy)propoxy]-hydroxyphosphino]oxyethyl-dimethylammonium IUPAC Name: 2-[[2-formyloxy-3-(3-tridecylphenoxy)propoxy]-hydroxyphosphanyl]oxyethyl-dimethylazanium Traditional Name: 2-[[2-formyloxy-3-(3-tridecylphenoxy)propoxy]-hydroxy-phosphino]oxyethyl-dimethyl-ammonium Formula: C27H49NO6P+ MolecularWeight: 514.654821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(O)OCC[NH+](C)C)OC=O

Isomeric SMILES

CCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(O)OCC[NH+](C)C)OC=O

InChI

InChI=1S/C27H48NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-16-25-17-15-18-26(21-25)31-22-27(32-24-29)23-34-35(30)33-20-19-28(2)3/h15,17-18,21,24,27,30H,4-14,16,19-20,22-23H2,1-3H3/p+1