(4E)-4-[(3-hydroxyphenyl)methylidene]-2-(4-iodophenyl)-5-methyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(3-hydroxyphenyl)methylidene]-2-(4-iodophenyl)-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[(3-hydroxyphenyl)methylene]-2-(4-iodophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-4-[(3-hydroxyphenyl)methylidene]-2-(4-iodophenyl)-5-methyl-3-pyrazolone IUPAC Name: (4E)-4-[(3-hydroxyphenyl)methylidene]-2-(4-iodophenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-(3-hydroxybenzylidene)-2-(4-iodophenyl)-5-methyl-2-pyrazolin-3-one Formula: C17H13IN2O2 MolecularWeight: 404.20179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=CC=C2)O)C3=CC=C(C=C3)I

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC(=CC=C2)O)C3=CC=C(C=C3)I

InChI

InChI=1S/C17H13IN2O2/c1-11-16(10-12-3-2-4-15(21)9-12)17(22)20(19-11)14-7-5-13(18)6-8-14/h2-10,21H,1H3/b16-10+