5-ethyl-5-(4-iodophenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-ethyl-5-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-ethyl-5-(4-iodophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-ethyl-5-(4-iodophenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-ethyl-5-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-ethyl-5-(4-iodophenyl)barbituric acid Formula: C12H11IN2O3 MolecularWeight: 358.13181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=O)NC1=O)C2=CC=C(C=C2)I

Isomeric SMILES

CCC1(C(=O)NC(=O)NC1=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C12H11IN2O3/c1-2-12(7-3-5-8(13)6-4-7)9(16)14-11(18)15-10(12)17/h3-6H,2H2,1H3,(H2,14,15,16,17,18)