sodium; 5-ethyl-4,6-bis(oxidanylidene)-5-pentan-2-yl-1H-pyrimidin-2-olate; sulfuric acid

Systemtic Name: sodium; 5-ethyl-4,6-bis(oxidanylidene)-5-pentan-2-yl-1H-pyrimidin-2-olate; sulfuric acid Openeye Name: sodium; 5-ethyl-5-(1-methylbutyl)-4,6-dioxo-1H-pyrimidin-2-olate; sulfuric acid CAS Name: sodium; 5-ethyl-4,6-dioxo-5-pentan-2-yl-1H-pyrimidin-2-olate; sulfuric acid IUPAC Name: sodium; 5-ethyl-4,6-dioxo-5-pentan-2-yl-1H-pyrimidin-2-olate; sulfuric acid Traditional Name: sodium; 5-ethyl-4,6-diketo-5-(1-methylbutyl)-1H-pyrimidin-2-olate; sulfuric acid Formula: C11H19N2NaO7S MolecularWeight: 346.33253

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(C(=O)NC(=NC1=O)[O-])CC.OS(=O)(=O)O.[Na+]

Isomeric SMILES

CCCC(C)C1(C(=O)NC(=NC1=O)[O-])CC.OS(=O)(=O)O.[Na+]

InChI

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