(5Z)-5-[(3-ethoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-1-methyl-1,3-diazinane-2,4,6-trione

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)NC(=O)N(C2=O)C

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C\2/C(=O)NC(=O)N(C2=O)C

InChI

InChI=1S/C14H13N3O7/c1-3-24-10-6-7(5-9(11(10)18)17(22)23)4-8-12(19)15-14(21)16(2)13(8)20/h4-6,18H,3H2,1-2H3,(H,15,19,21)/b8-4-