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

Systemtic Name: 1-(4-bromanyl-2-methyl-phenyl)-5-[(3,5-dimethoxy-4-oxidanyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-bromo-2-methyl-phenyl)-5-[(4-hydroxy-3,5-dimethoxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-bromo-2-methylphenyl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-bromo-2-methylphenyl)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-bromo-2-methyl-phenyl)-5-(4-hydroxy-3,5-dimethoxy-benzylidene)barbituric acid Formula: C20H17BrN2O6 MolecularWeight: 461.26278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)OC)C(=O)NC2=O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)OC)C(=O)NC2=O

InChI

InChI=1S/C20H17BrN2O6/c1-10-6-12(21)4-5-14(10)23-19(26)13(18(25)22-20(23)27)7-11-8-15(28-2)17(24)16(9-11)29-3/h4-9,24H,1-3H3,(H,22,25,27)