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

Systemtic Name: (4E)-2-(4-iodophenyl)-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one Openeye Name: (4E)-2-(4-iodophenyl)-5-methyl-4-(p-tolylmethylene)pyrazol-3-one CAS Name: (4E)-2-(4-iodophenyl)-5-methyl-4-[(4-methylphenyl)methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(4-iodophenyl)-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one Traditional Name: (4E)-2-(4-iodophenyl)-5-methyl-4-(4-methylbenzylidene)-2-pyrazolin-3-one Formula: C18H15IN2O MolecularWeight: 402.22897

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)I)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)I)C

InChI

InChI=1S/C18H15IN2O/c1-12-3-5-14(6-4-12)11-17-13(2)20-21(18(17)22)16-9-7-15(19)8-10-16/h3-11H,1-2H3/b17-11+