2-[[2-butanoyloxy-3-(2-tetradecoxyphenyl)propoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium

Systemtic Name: 2-[[2-butanoyloxy-3-(2-tetradecoxyphenyl)propoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium Openeye Name: 2-[[2-butanoyloxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxy-phosphanyl]oxyethyl-methyl-ammonium CAS Name: 2-[hydroxy-[2-(1-oxobutoxy)-3-(2-tetradecoxyphenyl)propoxy]phosphino]oxyethyl-methylammonium IUPAC Name: 2-[[2-butanoyloxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxyphosphanyl]oxyethyl-methylazanium Traditional Name: 2-[[2-butyryloxy-3-(2-myristyloxyphenyl)propoxy]-hydroxy-phosphino]oxyethyl-methyl-ammonium Formula: C30H55NO6P+ MolecularWeight: 556.734561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1CC(COP(O)OCC[NH2+]C)OC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1CC(COP(O)OCC[NH2+]C)OC(=O)CCC

InChI

InChI=1S/C30H54NO6P/c1-4-6-7-8-9-10-11-12-13-14-15-18-23-34-29-21-17-16-20-27(29)25-28(37-30(32)19-5-2)26-36-38(33)35-24-22-31-3/h16-17,20-21,28,31,33H,4-15,18-19,22-26H2,1-3H3/p+1