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

Systemtic Name: 5-[[5-(3-nitro-4-oxidanyl-phenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[5-(4-hydroxy-3-nitro-phenyl)-2-furyl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[5-(4-hydroxy-3-nitrophenyl)-2-furanyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[5-(4-hydroxy-3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[5-(4-hydroxy-3-nitro-phenyl)-2-furyl]methylene]barbituric acid Formula: C15H9N3O7 MolecularWeight: 343.24786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1C2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O)[N+](=O)[O-])O

InChI

InChI=1S/C15H9N3O7/c19-11-3-1-7(5-10(11)18(23)24)12-4-2-8(25-12)6-9-13(20)16-15(22)17-14(9)21/h1-6,19H,(H2,16,17,20,21,22)