(4E)-4-[[1-(3-iodanylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[1-(3-iodanylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[1-(3-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[1-(3-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C23H20IN3O MolecularWeight: 481.32887

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)I)C)/C=C/3\C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H20IN3O/c1-15-12-18(17(3)26(15)21-11-7-8-19(24)14-21)13-22-16(2)25-27(23(22)28)20-9-5-4-6-10-20/h4-14H,1-3H3/b22-13+