(4E)-2-(4-methoxy-3-nitro-phenyl)-4-[(4-morpholin-4-yl-3-nitro-phenyl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4E)-2-(4-methoxy-3-nitro-phenyl)-4-[(4-morpholin-4-yl-3-nitro-phenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-2-(4-methoxy-3-nitro-phenyl)-4-[(4-morpholino-3-nitro-phenyl)methylene]oxazol-5-one CAS Name: (4E)-2-(4-methoxy-3-nitrophenyl)-4-[[4-(4-morpholinyl)-3-nitrophenyl]methylidene]-5-oxazolone IUPAC Name: (4E)-2-(4-methoxy-3-nitrophenyl)-4-[(4-morpholin-4-yl-3-nitrophenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4E)-2-(4-methoxy-3-nitro-phenyl)-4-(4-morpholino-3-nitro-benzylidene)-2-oxazolin-5-one Formula: C21H18N4O8 MolecularWeight: 454.38962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CC3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C(=O)O2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=N/C(=C/C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])/C(=O)O2)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O8/c1-31-19-5-3-14(12-18(19)25(29)30)20-22-15(21(26)33-20)10-13-2-4-16(17(11-13)24(27)28)23-6-8-32-9-7-23/h2-5,10-12H,6-9H2,1H3/b15-10+