2-[[(2R)-3-decoxy-2-[3-(4-nitrophenoxy)carbonyloxypropanoyloxy]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2R)-3-decoxy-2-[3-(4-nitrophenoxy)carbonyloxypropanoyloxy]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2R)-3-decoxy-2-[3-(4-nitrophenoxy)carbonyloxypropanoyloxy]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(2R)-3-decoxy-2-[3-[(4-nitrophenoxy)-oxomethoxy]-1-oxopropoxy]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2R)-3-decoxy-2-[3-(4-nitrophenoxy)carbonyloxypropanoyloxy]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2R)-3-decoxy-2-[3-(4-nitrophenoxy)carbonyloxypropanoyloxy]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C28H48N2O12P+ MolecularWeight: 635.660681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCOC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCOC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C28H47N2O12P/c1-5-6-7-8-9-10-11-12-19-37-22-26(23-40-43(35,36)39-21-18-30(2,3)4)41-27(31)17-20-38-28(32)42-25-15-13-24(14-16-25)29(33)34/h13-16,26H,5-12,17-23H2,1-4H3/p+1/t26-/m1/s1