5-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-bromo-4,5-dimethoxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-bromo-4,5-dimethoxy-benzylidene)barbituric acid Formula: C13H11BrN2O5 MolecularWeight: 355.14084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)NC2=O)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)NC2=O)Br)OC

InChI

InChI=1S/C13H11BrN2O5/c1-20-9-5-6(4-8(14)10(9)21-2)3-7-11(17)15-13(19)16-12(7)18/h3-5H,1-2H3,(H2,15,16,17,18,19)