4-[[3-methoxy-5-nitro-4-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[3-methoxy-5-nitro-4-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-methoxy-5-nitro-4-[(5-nitro-2-pyridyl)oxy]phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-methoxy-5-nitro-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-methoxy-5-nitro-4-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[3-methoxy-5-nitro-4-[(5-nitro-2-pyridyl)oxy]benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C22H15N5O8 MolecularWeight: 477.3832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC2=NC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC2=NC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C=C3C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C22H15N5O8/c1-34-18-11-13(9-16-21(28)24-25(22(16)29)14-5-3-2-4-6-14)10-17(27(32)33)20(18)35-19-8-7-15(12-23-19)26(30)31/h2-12H,1H3,(H,24,28)