4-[4-(4-iodanylphenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(4-iodanylphenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 3-hydroxy-4-[4-(4-iodophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 3-hydroxy-4-[4-(4-iodophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 3-hydroxy-4-[4-(4-iodophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 3-hydroxy-4-[4-(4-iodophenoxy)-5-methyl-3-pyrazolin-3-ylidene]-2-methyl-cyclohexa-2,5-dien-1-one Formula: C17H15IN2O3 MolecularWeight: 422.21707

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C(NN2)C)OC3=CC=C(C=C3)I)C=CC1=O)O

Isomeric SMILES

CC1=C(C(=C2C(=C(NN2)C)OC3=CC=C(C=C3)I)C=CC1=O)O

InChI

InChI=1S/C17H15IN2O3/c1-9-14(21)8-7-13(16(9)22)15-17(10(2)19-20-15)23-12-5-3-11(18)4-6-12/h3-8,19-20,22H,1-2H3