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

Systemtic Name: (4E)-5-methyl-4-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4E)-5-methyl-4-[[5-(4-nitrophenyl)-2-furyl]methylene]-2-phenyl-pyrazol-3-one CAS Name: (4E)-5-methyl-4-[[5-(4-nitrophenyl)-2-furanyl]methylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4E)-5-methyl-4-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-phenylpyrazol-3-one Traditional Name: (4E)-5-methyl-4-[[5-(4-nitrophenyl)-2-furyl]methylene]-2-phenyl-2-pyrazolin-3-one Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15N3O4/c1-14-19(21(25)23(22-14)16-5-3-2-4-6-16)13-18-11-12-20(28-18)15-7-9-17(10-8-15)24(26)27/h2-13H,1H3/b19-13+