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

Systemtic Name: 3-[[3-(2-hexadecylphenoxy)-2-methanoyloxy-propoxy]-oxidanyl-phosphanyl]oxypropyl-dimethyl-azanium Openeye Name: 3-[[2-formyloxy-3-(2-hexadecylphenoxy)propoxy]-hydroxy-phosphanyl]oxypropyl-dimethyl-ammonium CAS Name: 3-[[2-formyloxy-3-(2-hexadecylphenoxy)propoxy]-hydroxyphosphino]oxypropyl-dimethylammonium IUPAC Name: 3-[[2-formyloxy-3-(2-hexadecylphenoxy)propoxy]-hydroxyphosphanyl]oxypropyl-dimethylazanium Traditional Name: 3-[[3-(2-cetylphenoxy)-2-formyloxy-propoxy]-hydroxy-phosphino]oxypropyl-dimethyl-ammonium Formula: C31H57NO6P+ MolecularWeight: 570.761141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H56NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-29-22-18-19-23-31(29)35-26-30(36-28-33)27-38-39(34)37-25-20-24-32(2)3/h18-19,22-23,28,30,34H,4-17,20-21,24-27H2,1-3H3/p+1