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

Systemtic Name: 2-[[2-butanoyloxy-3-(2-octadecoxyphenyl)propoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium Openeye Name: 2-[[2-butanoyloxy-3-(2-octadecoxyphenyl)propoxy]-hydroxy-phosphanyl]oxyethyl-methyl-ammonium CAS Name: 2-[hydroxy-[3-(2-octadecoxyphenyl)-2-(1-oxobutoxy)propoxy]phosphino]oxyethyl-methylammonium IUPAC Name: 2-[[2-butanoyloxy-3-(2-octadecoxyphenyl)propoxy]-hydroxyphosphanyl]oxyethyl-methylazanium Traditional Name: 2-[[2-butyryloxy-3-(2-stearyloxyphenyl)propoxy]-hydroxy-phosphino]oxyethyl-methyl-ammonium Formula: C34H63NO6P+ MolecularWeight: 612.840881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(COP(O)OCC[NH2+]C)OC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(COP(O)OCC[NH2+]C)OC(=O)CCC

InChI

InChI=1S/C34H62NO6P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-27-38-33-25-21-20-24-31(33)29-32(41-34(36)23-5-2)30-40-42(37)39-28-26-35-3/h20-21,24-25,32,35,37H,4-19,22-23,26-30H2,1-3H3/p+1