(3E)-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-5-(4-methylphenyl)furan-2-one

Systemtic Name: (3E)-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-5-(4-methylphenyl)furan-2-one Openeye Name: (3E)-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-5-(p-tolyl)furan-2-one CAS Name: (3E)-3-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-5-(4-methylphenyl)-2-furanone IUPAC Name: (3E)-3-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-5-(4-methylphenyl)furan-2-one Traditional Name: (3E)-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-5-(p-tolyl)furan-2-one Formula: C28H22N2O3 MolecularWeight: 434.48588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5)C(=O)O2

Isomeric SMILES

CC1=CC=C(C=C1)C2=C/C(=C\C3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5)/C(=O)O2

InChI

InChI=1S/C28H22N2O3/c1-19-8-10-20(11-9-19)26-17-22(28(31)33-26)16-23-18-30(24-6-4-3-5-7-24)29-27(23)21-12-14-25(32-2)15-13-21/h3-18H,1-2H3/b22-16+