5-heptan-2-yl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-heptan-2-yl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-methylhexyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-heptan-2-yl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-heptan-2-yl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-methylhexyl)barbituric acid Formula: C11H18N2O3 MolecularWeight: 226.27222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1C(=O)NC(=O)NC1=O

Isomeric SMILES

CCCCCC(C)C1C(=O)NC(=O)NC1=O

InChI

InChI=1S/C11H18N2O3/c1-3-4-5-6-7(2)8-9(14)12-11(16)13-10(8)15/h7-8H,3-6H2,1-2H3,(H2,12,13,14,15,16)