(4E)-4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-methyl-1H-pyrazol-5-one

Systemtic Name: (4E)-4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-methyl-1H-pyrazol-5-one Openeye Name: (4E)-4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-methyl-1H-pyrazol-5-one CAS Name: (4E)-4-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-methyl-1H-pyrazol-5-one IUPAC Name: (4E)-4-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-methyl-1H-pyrazol-5-one Traditional Name: (4E)-4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-5-methyl-2-pyrazolin-3-one Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C1=CC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC\1=NNC(=O)/C1=C/C2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2/c1-14-19(21(26)23-22-14)12-16-13-25(17-6-4-3-5-7-17)24-20(16)15-8-10-18(27-2)11-9-15/h3-13H,1-2H3,(H,23,26)/b19-12+