5-hexyl-5-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-hexyl-5-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-hexyl-5-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-hexyl-5-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-hexyl-5-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-hexyl-5-phenyl-barbituric acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2O3/c1-2-3-4-8-11-16(12-9-6-5-7-10-12)13(19)17-15(21)18-14(16)20/h5-7,9-10H,2-4,8,11H2,1H3,(H2,17,18,19,20,21)