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

Systemtic Name: methyl-[2-[[3-(2-octadecoxyphenyl)-2-propanoyloxy-propoxy]-oxidanyl-phosphanyl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[3-(2-octadecoxyphenyl)-2-propanoyloxy-propoxy]phosphanyl]oxyethyl-methyl-ammonium CAS Name: 2-[hydroxy-[3-(2-octadecoxyphenyl)-2-(1-oxopropoxy)propoxy]phosphino]oxyethyl-methylammonium IUPAC Name: 2-[hydroxy-[3-(2-octadecoxyphenyl)-2-propanoyloxypropoxy]phosphanyl]oxyethyl-methylazanium Traditional Name: 2-[hydroxy-[2-propionyloxy-3-(2-stearyloxyphenyl)propoxy]phosphino]oxyethyl-methyl-ammonium Formula: C33H61NO6P+ MolecularWeight: 598.814301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H60NO6P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-37-32-24-21-20-23-30(32)28-31(40-33(35)5-2)29-39-41(36)38-27-25-34-3/h20-21,23-24,31,34,36H,4-19,22,25-29H2,1-3H3/p+1