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

Systemtic Name: 5-[[5-(4-methyl-2-nitro-phenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[5-(4-methyl-2-nitro-phenyl)-2-furyl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[5-(4-methyl-2-nitrophenyl)-2-furanyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[5-(4-methyl-2-nitro-phenyl)-2-furyl]methylene]barbituric acid Formula: C16H11N3O6 MolecularWeight: 341.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O6/c1-8-2-4-10(12(6-8)19(23)24)13-5-3-9(25-13)7-11-14(20)17-16(22)18-15(11)21/h2-7H,1H3,(H2,17,18,20,21,22)