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

Systemtic Name: (4E)-5-methyl-4-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-2-(phenylcarbonyl)pyrazol-3-one Openeye Name: (4E)-2-benzoyl-5-methyl-4-[[5-(3-nitrophenyl)-2-furyl]methylene]pyrazol-3-one CAS Name: (4E)-2-benzoyl-5-methyl-4-[[5-(3-nitrophenyl)-2-furanyl]methylidene]-3-pyrazolone IUPAC Name: (4E)-2-benzoyl-5-methyl-4-[[5-(3-nitrophenyl)furan-2-yl]methylidene]pyrazol-3-one Traditional Name: (4E)-2-benzoyl-5-methyl-4-[[5-(3-nitrophenyl)-2-furyl]methylene]-2-pyrazolin-3-one Formula: C22H15N3O5 MolecularWeight: 401.3716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H15N3O5/c1-14-19(22(27)24(23-14)21(26)15-6-3-2-4-7-15)13-18-10-11-20(30-18)16-8-5-9-17(12-16)25(28)29/h2-13H,1H3/b19-13+