3-[[3-(4-dodecylphenoxy)-2-methanoyloxy-propoxy]-oxidanyl-phosphanyl]oxypropyl-ethyl-azanium

Systemtic Name: 3-[[3-(4-dodecylphenoxy)-2-methanoyloxy-propoxy]-oxidanyl-phosphanyl]oxypropyl-ethyl-azanium Openeye Name: 3-[[3-(4-dodecylphenoxy)-2-formyloxy-propoxy]-hydroxy-phosphanyl]oxypropyl-ethyl-ammonium CAS Name: 3-[[3-(4-dodecylphenoxy)-2-formyloxypropoxy]-hydroxyphosphino]oxypropyl-ethylammonium IUPAC Name: 3-[[3-(4-dodecylphenoxy)-2-formyloxypropoxy]-hydroxyphosphanyl]oxypropyl-ethylazanium Traditional Name: ethyl-[3-[[2-formyloxy-3-(4-laurylphenoxy)propoxy]-hydroxy-phosphino]oxypropyl]ammonium Formula: C27H49NO6P+ MolecularWeight: 514.654821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(O)OCCC[NH2+]CC)OC=O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(O)OCCC[NH2+]CC)OC=O

InChI

InChI=1S/C27H48NO6P/c1-3-5-6-7-8-9-10-11-12-13-15-25-16-18-26(19-17-25)31-22-27(32-24-29)23-34-35(30)33-21-14-20-28-4-2/h16-19,24,27-28,30H,3-15,20-23H2,1-2H3/p+1