sodium 5-ethyl-5-heptan-4-yl-pyrimidin-3-ide-2,4,6-trione

Systemtic Name: sodium 5-ethyl-5-heptan-4-yl-pyrimidin-3-ide-2,4,6-trione Openeye Name: sodium 5-ethyl-5-(1-propylbutyl)hexahydropyrimidin-3-ide-2,4,6-trione CAS Name: sodium 5-ethyl-5-heptan-4-ylpyrimidin-3-ide-2,4,6-trione IUPAC Name: sodium 5-ethyl-5-heptan-4-ylpyrimidin-3-ide-2,4,6-trione Traditional Name: sodium 5-ethyl-5-(1-propylbutyl)hexahydropyrimidin-3-ide-2,4,6-trione Formula: C13H21N2NaO3 MolecularWeight: 276.30721

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O3.Na/c1-4-7-9(8-5-2)13(6-3)10(16)14-12(18)15-11(13)17;/h9H,4-8H2,1-3H3,(H2,14,15,16,17,18);/q;+1/p-1