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

Systemtic Name: 5-[(5-bromanyl-2-butoxy-phenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(5-bromo-2-butoxy-phenyl)methylene]-1-(4-hydroxyphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(5-bromo-2-butoxyphenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(5-bromo-2-butoxyphenyl)methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(5-bromo-2-butoxy-benzylidene)-1-(4-hydroxyphenyl)barbituric acid Formula: C21H19BrN2O5 MolecularWeight: 459.28996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H19BrN2O5/c1-2-3-10-29-18-9-4-14(22)11-13(18)12-17-19(26)23-21(28)24(20(17)27)15-5-7-16(25)8-6-15/h4-9,11-12,25H,2-3,10H2,1H3,(H,23,26,28)