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

Systemtic Name: 5-[(5-methoxy-3-nitro-2-oxidanyl-phenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2-hydroxy-5-methoxy-3-nitro-phenyl)methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(2-hydroxy-5-methoxy-3-nitro-benzylidene)-1,3-dimethyl-barbituric acid Formula: C14H13N3O7 MolecularWeight: 335.26892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=CC(=C2O)[N+](=O)[O-])OC)C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=CC(=C2O)[N+](=O)[O-])OC)C(=O)N(C1=O)C

InChI

InChI=1S/C14H13N3O7/c1-15-12(19)9(13(20)16(2)14(15)21)5-7-4-8(24-3)6-10(11(7)18)17(22)23/h4-6,18H,1-3H3