sodium 5-ethyl-5-(2-methylbut-3-yn-2-yl)-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate

Systemtic Name: sodium 5-ethyl-5-(2-methylbut-3-yn-2-yl)-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate Openeye Name: sodium 5-(1,1-dimethylprop-2-ynyl)-5-ethyl-4,6-dioxo-1H-pyrimidin-2-olate CAS Name: sodium 5-ethyl-5-(2-methylbut-3-yn-2-yl)-4,6-dioxo-1H-pyrimidin-2-olate IUPAC Name: sodium 5-ethyl-5-(2-methylbut-3-yn-2-yl)-4,6-dioxo-1H-pyrimidin-2-olate Traditional Name: sodium 5-(1,1-dimethylprop-2-ynyl)-5-ethyl-4,6-diketo-1H-pyrimidin-2-olate Formula: C11H13N2NaO3 MolecularWeight: 244.22229

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=NC1=O)[O-])C(C)(C)C#C.[Na+]

Isomeric SMILES

CCC1(C(=O)NC(=NC1=O)[O-])C(C)(C)C#C.[Na+]

InChI

InChI=1S/C11H14N2O3.Na/c1-5-10(3,4)11(6-2)7(14)12-9(16)13-8(11)15;/h1H,6H2,2-4H3,(H2,12,13,14,15,16);/q;+1/p-1