(4E)-4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-5-methylidene-pyrazolidin-3-one

Systemtic Name: (4E)-4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-5-methylidene-pyrazolidin-3-one Openeye Name: (4E)-4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-5-methylene-pyrazolidin-3-one CAS Name: (4E)-4-[[3-(4-methoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]methylidene]-5-methylene-3-pyrazolidinone IUPAC Name: (4E)-4-[[3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-5-methylidenepyrazolidin-3-one Traditional Name: (4E)-4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-5-methylene-pyrazolidin-3-one Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=C)NNC3=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2/C=C/3\C(=C)NNC3=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O4/c1-13-17(21(27)23-22-13)10-15-12-25(16-6-4-3-5-7-16)24-20(15)14-8-9-19(30-2)18(11-14)26(28)29/h3-12,22H,1H2,2H3,(H,23,27)/b17-10+