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

Systemtic Name: 3-[[2-acetyloxy-3-(2-tetradecoxyphenyl)propoxy]-oxidanyl-phosphanyl]oxypropyl-methyl-azanium Openeye Name: 3-[[2-acetoxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxy-phosphanyl]oxypropyl-methyl-ammonium CAS Name: 3-[[2-acetyloxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxyphosphino]oxypropyl-methylammonium IUPAC Name: 3-[[2-acetyloxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxyphosphanyl]oxypropyl-methylazanium Traditional Name: 3-[[2-acetoxy-3-(2-myristyloxyphenyl)propoxy]-hydroxy-phosphino]oxypropyl-methyl-ammonium Formula: C29H53NO6P+ MolecularWeight: 542.707981

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H52NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-17-22-33-29-20-16-15-19-27(29)24-28(36-26(2)31)25-35-37(32)34-23-18-21-30-3/h15-16,19-20,28,30,32H,4-14,17-18,21-25H2,1-3H3/p+1