2-[[3-(4-hexadecylphenoxy)-2-methoxy-propoxy]-oxidanyl-phosphanyl]oxyethyl-dimethyl-azanium

Systemtic Name: 2-[[3-(4-hexadecylphenoxy)-2-methoxy-propoxy]-oxidanyl-phosphanyl]oxyethyl-dimethyl-azanium Openeye Name: 2-[[3-(4-hexadecylphenoxy)-2-methoxy-propoxy]-hydroxy-phosphanyl]oxyethyl-dimethyl-ammonium CAS Name: 2-[[3-(4-hexadecylphenoxy)-2-methoxypropoxy]-hydroxyphosphino]oxyethyl-dimethylammonium IUPAC Name: 2-[[3-(4-hexadecylphenoxy)-2-methoxypropoxy]-hydroxyphosphanyl]oxyethyl-dimethylazanium Traditional Name: 2-[[3-(4-cetylphenoxy)-2-methoxy-propoxy]-hydroxy-phosphino]oxyethyl-dimethyl-ammonium Formula: C30H57NO5P+ MolecularWeight: 542.751041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(O)OCC[NH+](C)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(O)OCC[NH+](C)C)OC

InChI

InChI=1S/C30H56NO5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28-20-22-29(23-21-28)34-26-30(33-4)27-36-37(32)35-25-24-31(2)3/h20-23,30,32H,5-19,24-27H2,1-4H3/p+1