3-[[2-acetyloxy-3-(2-octadecoxyphenyl)propoxy]-oxidanyl-phosphanyl]oxypropyl-methyl-azanium

Systemtic Name: 3-[[2-acetyloxy-3-(2-octadecoxyphenyl)propoxy]-oxidanyl-phosphanyl]oxypropyl-methyl-azanium Openeye Name: 3-[[2-acetoxy-3-(2-octadecoxyphenyl)propoxy]-hydroxy-phosphanyl]oxypropyl-methyl-ammonium CAS Name: 3-[[2-acetyloxy-3-(2-octadecoxyphenyl)propoxy]-hydroxyphosphino]oxypropyl-methylammonium IUPAC Name: 3-[[2-acetyloxy-3-(2-octadecoxyphenyl)propoxy]-hydroxyphosphanyl]oxypropyl-methylazanium Traditional Name: 3-[[2-acetoxy-3-(2-stearyloxyphenyl)propoxy]-hydroxy-phosphino]oxypropyl-methyl-ammonium Formula: C33H61NO6P+ MolecularWeight: 598.814301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H60NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26-37-33-24-20-19-23-31(33)28-32(40-30(2)35)29-39-41(36)38-27-22-25-34-3/h19-20,23-24,32,34,36H,4-18,21-22,25-29H2,1-3H3/p+1