(5E)-5-[(3-bromanyl-4-oxidanyl-phenyl)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione

Systemtic Name: (5E)-5-[(3-bromanyl-4-oxidanyl-phenyl)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione Openeye Name: (5E)-1-allyl-5-[(3-bromo-4-hydroxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: (5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione IUPAC Name: (5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione Traditional Name: (5E)-1-allyl-5-(3-bromo-4-hydroxy-benzylidene)barbituric acid Formula: C14H11BrN2O4 MolecularWeight: 351.15214

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC(=C(C=C2)O)Br)C(=O)NC1=O

Isomeric SMILES

C=CCN1C(=O)/C(=C/C2=CC(=C(C=C2)O)Br)/C(=O)NC1=O

InChI

InChI=1S/C14H11BrN2O4/c1-2-5-17-13(20)9(12(19)16-14(17)21)6-8-3-4-11(18)10(15)7-8/h2-4,6-7,18H,1,5H2,(H,16,19,21)/b9-6+