2-[[(2S)-2-acetamido-3-hexadecylsulfanyl-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2S)-2-acetamido-3-hexadecylsulfanyl-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2S)-2-acetamido-3-hexadecylsulfanyl-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(2S)-2-acetamido-3-(hexadecylthio)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2S)-2-acetamido-3-hexadecylsulfanylpropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2S)-2-acetamido-3-(cetylthio)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C26H56N2O5PS+ MolecularWeight: 539.772001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(COP(=O)(O)OCC[N+](C)(C)C)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCSC[C@H](COP(=O)(O)OCC[N+](C)(C)C)NC(=O)C

InChI

InChI=1S/C26H55N2O5PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-35-24-26(27-25(2)29)23-33-34(30,31)32-21-20-28(3,4)5/h26H,6-24H2,1-5H3,(H-,27,29,30,31)/p+1/t26-/m0/s1