magnesium; sodium; 5-ethyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione; 2,2,2-tris(chloranyl)ethane-1,1-diol; sulfate

Systemtic Name: magnesium; sodium; 5-ethyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione; 2,2,2-tris(chloranyl)ethane-1,1-diol; sulfate Openeye Name: magnesium; sodium; 5-ethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione; 2,2,2-trichloroethane-1,1-diol; sulfate CAS Name: magnesium; sodium; 5-ethyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione; 2,2,2-trichloroethane-1,1-diol; sulfate IUPAC Name: magnesium; sodium; 5-ethyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione; 2,2,2-trichloroethane-1,1-diol; sulfate Traditional Name: magnesium; sodium; 5-ethyl-5-(1-methylbutyl)barbituric acid; 2,2,2-trichloroethane-1,1-diol; sulfate Formula: C13H21Cl3MgN2NaO9S+ MolecularWeight: 535.03261

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(C(=O)NC(=O)NC1=O)CC.C(C(Cl)(Cl)Cl)(O)O.[O-]S(=O)(=O)[O-].[Na+].[Mg+2]

Isomeric SMILES

CCCC(C)C1(C(=O)NC(=O)NC1=O)CC.C(C(Cl)(Cl)Cl)(O)O.[O-]S(=O)(=O)[O-].[Na+].[Mg+2]

InChI

InChI=1S/C11H18N2O3.C2H3Cl3O2.Mg.Na.H2O4S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15;3-2(4,5)1(6)7;;;1-5(2,3)4/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16);1,6-7H;;;(H2,1,2,3,4)/q;;+2;+1;/p-2