5-pentyl-5-prop-1-en-2-yl-1,3-diazinane-2,4,6-trione; sodium

Systemtic Name: 5-pentyl-5-prop-1-en-2-yl-1,3-diazinane-2,4,6-trione; sodium Openeye Name: 5-isopropenyl-5-pentyl-hexahydropyrimidine-2,4,6-trione; sodium CAS Name: 5-(1-methylethenyl)-5-pentyl-1,3-diazinane-2,4,6-trione; sodium IUPAC Name: 5-pentyl-5-prop-1-en-2-yl-1,3-diazinane-2,4,6-trione; sodium Traditional Name: 5-amyl-5-isopropenyl-barbituric acid; sodium Formula: C12H18N2NaO3 MolecularWeight: 261.27269

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C(=O)NC(=O)NC1=O)C(=C)C.[Na]

Isomeric SMILES

CCCCCC1(C(=O)NC(=O)NC1=O)C(=C)C.[Na]

InChI

InChI=1S/C12H18N2O3.Na/c1-4-5-6-7-12(8(2)3)9(15)13-11(17)14-10(12)16;/h2,4-7H2,1,3H3,(H2,13,14,15,16,17);