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

Systemtic Name: (4E)-4-[[5-(3-chlorophenyl)furan-2-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[5-(3-chlorophenyl)-2-furyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[5-(3-chlorophenyl)-2-furanyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[5-(3-chlorophenyl)furan-2-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[[5-(3-chlorophenyl)-2-furyl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C21H15ClN2O2 MolecularWeight: 362.809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H15ClN2O2/c1-14-19(21(25)24(23-14)17-8-3-2-4-9-17)13-18-10-11-20(26-18)15-6-5-7-16(22)12-15/h2-13H,1H3/b19-13+