2-[[2-butanoyloxy-3-(2-tetradecylphenoxy)propoxy]-oxidanyl-phosphanyl]oxyethyl-ethyl-azanium

Systemtic Name: 2-[[2-butanoyloxy-3-(2-tetradecylphenoxy)propoxy]-oxidanyl-phosphanyl]oxyethyl-ethyl-azanium Openeye Name: 2-[[2-butanoyloxy-3-(2-tetradecylphenoxy)propoxy]-hydroxy-phosphanyl]oxyethyl-ethyl-ammonium CAS Name: ethyl-[2-[hydroxy-[2-(1-oxobutoxy)-3-(2-tetradecylphenoxy)propoxy]phosphino]oxyethyl]ammonium IUPAC Name: 2-[[2-butanoyloxy-3-(2-tetradecylphenoxy)propoxy]-hydroxyphosphanyl]oxyethyl-ethylazanium Traditional Name: 2-[[2-butyryloxy-3-(2-myristylphenoxy)propoxy]-hydroxy-phosphino]oxyethyl-ethyl-ammonium Formula: C31H57NO6P+ MolecularWeight: 570.761141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCC[NH2+]CC)OC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCC[NH2+]CC)OC(=O)CCC

InChI

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