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

Systemtic Name: 1,3-dimethyl-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]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[5-(4-hydroxy-3-nitrophenyl)-2-furanyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[5-(4-hydroxy-3-nitrophenyl)furan-2-yl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[5-(4-hydroxy-3-nitro-phenyl)-2-furyl]methylene]-1,3-dimethyl-barbituric acid Formula: C17H13N3O7 MolecularWeight: 371.30102

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)N(C1=O)C

InChI

InChI=1S/C17H13N3O7/c1-18-15(22)11(16(23)19(2)17(18)24)8-10-4-6-14(27-10)9-3-5-13(21)12(7-9)20(25)26/h3-8,21H,1-2H3