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

Systemtic Name: (5Z)-1-methyl-5-[(2-morpholin-4-yl-5-nitro-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: (5Z)-1-methyl-5-[(2-morpholino-5-nitro-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: (5Z)-1-methyl-5-[[2-(4-morpholinyl)-5-nitrophenyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: (5Z)-1-methyl-5-[(2-morpholin-4-yl-5-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: (5Z)-1-methyl-5-(2-morpholino-5-nitro-benzylidene)barbituric acid Formula: C16H16N4O6 MolecularWeight: 360.32144

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C(=O)NC1=O

Isomeric SMILES

CN1C(=O)/C(=C\C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)/C(=O)NC1=O

InChI

InChI=1S/C16H16N4O6/c1-18-15(22)12(14(21)17-16(18)23)9-10-8-11(20(24)25)2-3-13(10)19-4-6-26-7-5-19/h2-3,8-9H,4-7H2,1H3,(H,17,21,23)/b12-9-