(4Z)-4-[(3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[(3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-4-[(3-ethoxy-5-iodo-4-isopropoxy-phenyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-[(3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-4-[(3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4Z)-4-(3-ethoxy-5-iodo-4-isopropoxy-benzylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C22H23IN2O3 MolecularWeight: 490.33409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)I)OC(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C\2/C(=NN(C2=O)C3=CC=CC=C3)C)I)OC(C)C

InChI

InChI=1S/C22H23IN2O3/c1-5-27-20-13-16(12-19(23)21(20)28-14(2)3)11-18-15(4)24-25(22(18)26)17-9-7-6-8-10-17/h6-14H,5H2,1-4H3/b18-11-