2-[[2-acetyloxy-3-(3-ethylpentadecoxy)propoxy]-oxidanyl-phosphoryl]ethyl-diethyl-azanium

Systemtic Name: 2-[[2-acetyloxy-3-(3-ethylpentadecoxy)propoxy]-oxidanyl-phosphoryl]ethyl-diethyl-azanium Openeye Name: 2-[[2-acetoxy-3-(3-ethylpentadecoxy)propoxy]-hydroxy-phosphoryl]ethyl-diethyl-ammonium CAS Name: 2-[[2-acetyloxy-3-(3-ethylpentadecoxy)propoxy]-hydroxyphosphoryl]ethyl-diethylammonium IUPAC Name: 2-[[2-acetyloxy-3-(3-ethylpentadecoxy)propoxy]-hydroxyphosphoryl]ethyl-diethylazanium Traditional Name: 2-[[2-acetoxy-3-(3-ethylpentadecoxy)propoxy]-hydroxy-phosphoryl]ethyl-diethyl-ammonium Formula: C28H59NO6P+ MolecularWeight: 536.744921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC)CCOCC(COP(=O)(CC[NH+](CC)CC)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCC(CC)CCOCC(COP(=O)(CC[NH+](CC)CC)O)OC(=O)C

InChI

InChI=1S/C28H58NO6P/c1-6-10-11-12-13-14-15-16-17-18-19-27(7-2)20-22-33-24-28(35-26(5)30)25-34-36(31,32)23-21-29(8-3)9-4/h27-28H,6-25H2,1-5H3,(H,31,32)/p+1