(4E)-4-[[5-(2-methoxy-4-nitro-phenyl)furan-2-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[5-(2-methoxy-4-nitro-phenyl)furan-2-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[5-(2-methoxy-4-nitro-phenyl)-2-furyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[5-(2-methoxy-4-nitrophenyl)-2-furanyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[[5-(2-methoxy-4-nitro-phenyl)-2-furyl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])OC)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])OC)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O5/c1-14-19(22(26)24(23-14)15-6-4-3-5-7-15)13-17-9-11-20(30-17)18-10-8-16(25(27)28)12-21(18)29-2/h3-13H,1-2H3/b19-13+