2-[[(2R)-3-decoxy-2-[[(Z)-3-oxidanylidenebut-1-enyl]amino]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2R)-3-decoxy-2-[[(Z)-3-oxidanylidenebut-1-enyl]amino]propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2R)-3-decoxy-2-[[(Z)-3-oxobut-1-enyl]amino]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(2R)-3-decoxy-2-[[(Z)-3-oxobut-1-enyl]amino]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2R)-3-decoxy-2-[[(Z)-3-oxobut-1-enyl]amino]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2R)-3-decoxy-2-[[(Z)-3-ketobut-1-enyl]amino]propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C22H46N2O6P+ MolecularWeight: 466.584347

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCOC[C@H](CO[32P](=O)(O)OCC[N+](C)(C)C)N/C=C\C(=O)C

InChI

InChI=1S/C22H45N2O6P/c1-6-7-8-9-10-11-12-13-17-28-19-22(23-15-14-21(2)25)20-30-31(26,27)29-18-16-24(3,4)5/h14-15,22H,6-13,16-20H2,1-5H3,(H-,23,25,26,27)/p+1/t22-/m1/s1/i31+1