sodium 5-butan-2-yl-5-propyl-1,3-diazinane-2,4,6-trione

Systemtic Name: sodium 5-butan-2-yl-5-propyl-1,3-diazinane-2,4,6-trione Openeye Name: sodium 5-propyl-5-sec-butyl-hexahydropyrimidine-2,4,6-trione CAS Name: sodium 5-butan-2-yl-5-propyl-1,3-diazinane-2,4,6-trione IUPAC Name: sodium 5-butan-2-yl-5-propyl-1,3-diazinane-2,4,6-trione Traditional Name: sodium 5-propyl-5-sec-butyl-barbituric acid Formula: C11H18N2NaO3+ MolecularWeight: 249.26199

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)NC(=O)NC1=O)C(C)CC.[Na+]

Isomeric SMILES

CCCC1(C(=O)NC(=O)NC1=O)C(C)CC.[Na+]

InChI

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