5-heptyl-1,3-diazinane-2,4,6-trione; sodium

Systemtic Name: 5-heptyl-1,3-diazinane-2,4,6-trione; sodium Openeye Name: 5-heptylhexahydropyrimidine-2,4,6-trione; sodium CAS Name: 5-heptyl-1,3-diazinane-2,4,6-trione; sodium IUPAC Name: 5-heptyl-1,3-diazinane-2,4,6-trione; sodium Traditional Name: 5-heptylbarbituric acid; sodium Formula: C11H18N2NaO3 MolecularWeight: 249.26199

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=O)NC(=O)NC1=O.[Na]

Isomeric SMILES

CCCCCCCC1C(=O)NC(=O)NC1=O.[Na]

InChI

InChI=1S/C11H18N2O3.Na/c1-2-3-4-5-6-7-8-9(14)12-11(16)13-10(8)15;/h8H,2-7H2,1H3,(H2,12,13,14,15,16);