4-[(4-butoxy-3-methoxy-phenyl)methylidene]-1-(3,4-dichlorophenyl)pyrazolidine-3,5-dione

Systemtic Name: 4-[(4-butoxy-3-methoxy-phenyl)methylidene]-1-(3,4-dichlorophenyl)pyrazolidine-3,5-dione Openeye Name: 4-[(4-butoxy-3-methoxy-phenyl)methylene]-1-(3,4-dichlorophenyl)pyrazolidine-3,5-dione CAS Name: 4-[(4-butoxy-3-methoxyphenyl)methylidene]-1-(3,4-dichlorophenyl)pyrazolidine-3,5-dione IUPAC Name: 4-[(4-butoxy-3-methoxyphenyl)methylidene]-1-(3,4-dichlorophenyl)pyrazolidine-3,5-dione Traditional Name: 4-(4-butoxy-3-methoxy-benzylidene)-1-(3,4-dichlorophenyl)pyrazolidine-3,5-quinone Formula: C21H20Cl2N2O4 MolecularWeight: 435.3005

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC(=C(C=C3)Cl)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC(=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C21H20Cl2N2O4/c1-3-4-9-29-18-8-5-13(11-19(18)28-2)10-15-20(26)24-25(21(15)27)14-6-7-16(22)17(23)12-14/h5-8,10-12H,3-4,9H2,1-2H3,(H,24,26)