2-(3-bromophenyl)-4-[(3-chloranyl-5-ethoxy-4-methoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one

Systemtic Name: 2-(3-bromophenyl)-4-[(3-chloranyl-5-ethoxy-4-methoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one Openeye Name: 2-(3-bromophenyl)-4-[(3-chloro-5-ethoxy-4-methoxy-phenyl)methylene]-5-methyl-pyrazol-3-one CAS Name: 2-(3-bromophenyl)-4-[(3-chloro-5-ethoxy-4-methoxyphenyl)methylidene]-5-methyl-3-pyrazolone IUPAC Name: 2-(3-bromophenyl)-4-[(3-chloro-5-ethoxy-4-methoxyphenyl)methylidene]-5-methylpyrazol-3-one Traditional Name: 2-(3-bromophenyl)-4-(3-chloro-5-ethoxy-4-methoxy-benzylidene)-5-methyl-2-pyrazolin-3-one Formula: C20H18BrClN2O3 MolecularWeight: 449.72552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrClN2O3/c1-4-27-18-10-13(9-17(22)19(18)26-3)8-16-12(2)23-24(20(16)25)15-7-5-6-14(21)11-15/h5-11H,4H2,1-3H3