2-[[(2R)-2-(2-azido-4-nitro-phenyl)carbonyloxy-3-hexadecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2R)-2-(2-azido-4-nitro-phenyl)carbonyloxy-3-hexadecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2R)-2-(2-azido-4-nitro-benzoyl)oxy-3-hexadecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(2R)-2-[(2-azido-4-nitrophenyl)-oxomethoxy]-3-(1-oxohexadecoxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2R)-2-(2-azido-4-nitrobenzoyl)oxy-3-hexadecanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2R)-2-(2-azido-4-nitro-benzoyl)oxy-3-hexadecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C31H53N5O10P+ MolecularWeight: 686.753781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])N=[N+]=[N-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])N=[N+]=[N-]

InChI

InChI=1S/C31H52N5O10P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-30(37)43-24-27(25-45-47(41,42)44-22-21-36(2,3)4)46-31(38)28-20-19-26(35(39)40)23-29(28)33-34-32/h19-20,23,27H,5-18,21-22,24-25H2,1-4H3/p+1/t27-/m1/s1