4-[[3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-5-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-5-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-methoxy-4-(2-morpholino-2-oxo-ethoxy)-5-nitro-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]-5-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-5-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[4-(2-keto-2-morpholino-ethoxy)-3-methoxy-5-nitro-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C23H22N4O8 MolecularWeight: 482.44278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC(=O)N2CCOCC2)[N+](=O)[O-])C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OCC(=O)N2CCOCC2)[N+](=O)[O-])C=C3C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O8/c1-33-19-13-15(11-17-22(29)24-26(23(17)30)16-5-3-2-4-6-16)12-18(27(31)32)21(19)35-14-20(28)25-7-9-34-10-8-25/h2-6,11-13H,7-10,14H2,1H3,(H,24,29)