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

Systemtic Name: 5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-1-(p-tolyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-hydroxy-3-methoxy-5-nitro-benzylidene)-1-(p-tolyl)barbituric acid Formula: C19H15N3O7 MolecularWeight: 397.3383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])C(=O)NC2=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])C(=O)NC2=O

InChI

InChI=1S/C19H15N3O7/c1-10-3-5-12(6-4-10)21-18(25)13(17(24)20-19(21)26)7-11-8-14(22(27)28)16(23)15(9-11)29-2/h3-9,23H,1-2H3,(H,20,24,26)