4-[(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione

Systemtic Name: 4-[(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Openeye Name: 4-[(3-bromo-5-ethoxy-4-hydroxy-phenyl)methylene]-1-(m-tolyl)pyrazolidine-3,5-dione CAS Name: 4-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione IUPAC Name: 4-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Traditional Name: 4-(3-bromo-5-ethoxy-4-hydroxy-benzylidene)-1-(m-tolyl)pyrazolidine-3,5-quinone Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O4/c1-3-26-16-10-12(9-15(20)17(16)23)8-14-18(24)21-22(19(14)25)13-6-4-5-11(2)7-13/h4-10,23H,3H2,1-2H3,(H,21,24)