2-[[(E)-2-acetamido-3-oxidanyl-hex-4-enoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(E)-2-acetamido-3-oxidanyl-hex-4-enoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(E)-2-acetamido-3-hydroxy-hex-4-enoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(E)-2-acetamido-3-hydroxyhex-4-enoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(E)-2-acetamido-3-hydroxyhex-4-enoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(E)-2-acetamido-3-hydroxy-hex-4-enoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C13H28N2O6P+ MolecularWeight: 339.344981

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H27N2O6P/c1-6-7-13(17)12(14-11(2)16)10-21-22(18,19)20-9-8-15(3,4)5/h6-7,12-13,17H,8-10H2,1-5H3,(H-,14,16,18,19)/p+1/b7-6+