(4E)-4-[(4-morpholin-4-yl-3-nitro-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4E)-4-[(4-morpholin-4-yl-3-nitro-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[(4-morpholino-3-nitro-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[[4-(4-morpholinyl)-3-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[(4-morpholin-4-yl-3-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-(4-morpholino-3-nitro-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)/C=C/3\C(=O)NN(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5/c25-19-16(20(26)23(21-19)15-4-2-1-3-5-15)12-14-6-7-17(18(13-14)24(27)28)22-8-10-29-11-9-22/h1-7,12-13H,8-11H2,(H,21,25)/b16-12+