1-(2,5-dimethoxyphenyl)-5-[(2-nitro-3H-furan-1-ium-5-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(2,5-dimethoxyphenyl)-5-[(2-nitro-3H-furan-1-ium-5-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2,5-dimethoxyphenyl)-5-[(2-nitro-3H-furan-1-ium-5-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2,5-dimethoxyphenyl)-5-[(2-nitro-3H-furan-1-ium-5-yl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(2,5-dimethoxyphenyl)-5-[(2-nitro-3H-furan-1-ium-5-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2,5-dimethoxyphenyl)-5-[(2-nitro-3H-furan-1-ium-5-yl)methylene]barbituric acid Formula: C17H14N3O8+ MolecularWeight: 388.30836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=O)C(=CC3=CCC(=[O+]3)[N+](=O)[O-])C(=O)NC2=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=O)C(=CC3=CCC(=[O+]3)[N+](=O)[O-])C(=O)NC2=O

InChI

InChI=1S/C17H13N3O8/c1-26-9-3-5-13(27-2)12(8-9)19-16(22)11(15(21)18-17(19)23)7-10-4-6-14(28-10)20(24)25/h3-5,7-8H,6H2,1-2H3/p+1