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

Systemtic Name: 5-[(4,5-dimethoxy-2-nitro-phenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4,5-dimethoxy-2-nitro-phenyl)methylene]-1-(2-furylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-1-(2-furanylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4,5-dimethoxy-2-nitro-benzylidene)-1-(2-furfuryl)barbituric acid Formula: C18H15N3O8 MolecularWeight: 401.327

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H15N3O8/c1-27-14-7-10(13(21(25)26)8-15(14)28-2)6-12-16(22)19-18(24)20(17(12)23)9-11-4-3-5-29-11/h3-8H,9H2,1-2H3,(H,19,22,24)