tetrasodium [[[(E)-3-methyl-4-oxidanyl-but-2-enoxy]-oxidanidyl-phosphoryl]oxy-oxidanidyl-phosphoryl] phosphate

Systemtic Name: tetrasodium [[[(E)-3-methyl-4-oxidanyl-but-2-enoxy]-oxidanidyl-phosphoryl]oxy-oxidanidyl-phosphoryl] phosphate Openeye Name: tetrasodium [[[(E)-4-hydroxy-3-methyl-but-2-enoxy]-oxido-phosphoryl]oxy-oxido-phosphoryl] phosphate CAS Name: tetrasodium [[[(E)-4-hydroxy-3-methylbut-2-enoxy]-oxidophosphoryl]oxy-oxidophosphoryl] phosphate IUPAC Name: tetrasodium [[[(E)-4-hydroxy-3-methylbut-2-enoxy]-oxidophosphoryl]oxy-oxidophosphoryl] phosphate Traditional Name: tetrasodium [[[(E)-4-hydroxy-3-methyl-but-2-enoxy]-oxido-phosphoryl]oxy-oxido-phosphoryl] phosphate Formula: C5H9Na4O11P3 MolecularWeight: 429.998723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])CO.[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C/C(=C\COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])/CO.[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C5H13O11P3.4Na/c1-5(4-6)2-3-14-18(10,11)16-19(12,13)15-17(7,8)9;;;;/h2,6H,3-4H2,1H3,(H,10,11)(H,12,13)(H2,7,8,9);;;;/q;4*+1/p-4/b5-2+;;;;