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

Systemtic Name: 2-[[2-acetyloxy-3-(2-tetradecoxyphenyl)propoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium Openeye Name: 2-[[2-acetoxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxy-phosphanyl]oxyethyl-methyl-ammonium CAS Name: 2-[[2-acetyloxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxyphosphino]oxyethyl-methylammonium IUPAC Name: 2-[[2-acetyloxy-3-(2-tetradecoxyphenyl)propoxy]-hydroxyphosphanyl]oxyethyl-methylazanium Traditional Name: 2-[[2-acetoxy-3-(2-myristyloxyphenyl)propoxy]-hydroxy-phosphino]oxyethyl-methyl-ammonium Formula: C28H51NO6P+ MolecularWeight: 528.681401

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H50NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-17-21-32-28-19-16-15-18-26(28)23-27(35-25(2)30)24-34-36(31)33-22-20-29-3/h15-16,18-19,27,29,31H,4-14,17,20-24H2,1-3H3/p+1