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

Systemtic Name: (4E)-4-[[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methylidene]-2-(3-chlorophenyl)-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methylene]-2-(3-chlorophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-4-[[5-(3-chloro-2-methylphenyl)-2-furanyl]methylidene]-2-(3-chlorophenyl)-5-methyl-3-pyrazolone IUPAC Name: (4E)-4-[[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene]-2-(3-chlorophenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methylene]-2-(3-chlorophenyl)-5-methyl-2-pyrazolin-3-one Formula: C22H16Cl2N2O2 MolecularWeight: 411.28064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)/C=C/3\C(=NN(C3=O)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C22H16Cl2N2O2/c1-13-18(7-4-8-20(13)24)21-10-9-17(28-21)12-19-14(2)25-26(22(19)27)16-6-3-5-15(23)11-16/h3-12H,1-2H3/b19-12+