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

Systemtic Name: (4E)-4-[(4-dimethylaminophenyl)methylidene]-2-(4-iodophenyl)-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-dimethylaminophenyl)methylene]-2-(4-iodophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-4-[(4-dimethylaminophenyl)methylidene]-2-(4-iodophenyl)-5-methyl-3-pyrazolone IUPAC Name: (4E)-4-[(4-dimethylaminophenyl)methylidene]-2-(4-iodophenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-[4-(dimethylamino)benzylidene]-2-(4-iodophenyl)-5-methyl-2-pyrazolin-3-one Formula: C19H18IN3O MolecularWeight: 431.27019

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18IN3O/c1-13-18(12-14-4-8-16(9-5-14)22(2)3)19(24)23(21-13)17-10-6-15(20)7-11-17/h4-12H,1-3H3/b18-12+