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

Systemtic Name: 5-[(2-bromanyl-5-ethoxy-4-propoxy-phenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2-bromo-5-ethoxy-4-propoxy-phenyl)methylene]-1-(4-hydroxyphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(2-bromo-5-ethoxy-4-propoxy-benzylidene)-1-(4-hydroxyphenyl)barbituric acid Formula: C22H21BrN2O6 MolecularWeight: 489.31594

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)Br)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)Br)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)O)OCC

InChI

InChI=1S/C22H21BrN2O6/c1-3-9-31-19-12-17(23)13(11-18(19)30-4-2)10-16-20(27)24-22(29)25(21(16)28)14-5-7-15(26)8-6-14/h5-8,10-12,26H,3-4,9H2,1-2H3,(H,24,27,29)