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

Systemtic Name: 5-[(5-bromanyl-2-nitro-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(5-bromo-2-nitro-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(5-bromo-2-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(5-bromo-2-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(5-bromo-2-nitro-benzylidene)barbituric acid Formula: C11H6BrN3O5 MolecularWeight: 340.08644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C=C2C(=O)NC(=O)NC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Br)C=C2C(=O)NC(=O)NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C11H6BrN3O5/c12-6-1-2-8(15(19)20)5(3-6)4-7-9(16)13-11(18)14-10(7)17/h1-4H,(H2,13,14,16,17,18)