4-[(3-chloranyl-4,5-diethoxy-phenyl)methylidene]-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione

Systemtic Name: 4-[(3-chloranyl-4,5-diethoxy-phenyl)methylidene]-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione Openeye Name: 4-[(3-chloro-4,5-diethoxy-phenyl)methylene]-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione CAS Name: 4-[(3-chloro-4,5-diethoxyphenyl)methylidene]-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione IUPAC Name: 4-[(3-chloro-4,5-diethoxyphenyl)methylidene]-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione Traditional Name: 4-(3-chloro-4,5-diethoxy-benzylidene)-1-(3,4-dimethylphenyl)pyrazolidine-3,5-quinone Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN2O4/c1-5-28-19-12-15(11-18(23)20(19)29-6-2)10-17-21(26)24-25(22(17)27)16-8-7-13(3)14(4)9-16/h7-12H,5-6H2,1-4H3,(H,24,26)