sodium 5-butan-2-yl-5-prop-2-ynyl-pyrimidin-3-ide-2,4,6-trione

Systemtic Name: sodium 5-butan-2-yl-5-prop-2-ynyl-pyrimidin-3-ide-2,4,6-trione Openeye Name: sodium 5-prop-2-ynyl-5-sec-butyl-hexahydropyrimidin-3-ide-2,4,6-trione CAS Name: sodium 5-butan-2-yl-5-prop-2-ynylpyrimidin-3-ide-2,4,6-trione IUPAC Name: sodium 5-butan-2-yl-5-prop-2-ynylpyrimidin-3-ide-2,4,6-trione Traditional Name: sodium 5-propargyl-5-sec-butyl-hexahydropyrimidin-3-ide-2,4,6-trione Formula: C11H13N2NaO3 MolecularWeight: 244.22229

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(C(=O)NC(=O)[N-]C1=O)CC#C.[Na+]

Isomeric SMILES

CCC(C)C1(C(=O)NC(=O)[N-]C1=O)CC#C.[Na+]

InChI

InChI=1S/C11H14N2O3.Na/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15;/h1,7H,5-6H2,2-3H3,(H2,12,13,14,15,16);/q;+1/p-1