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

Systemtic Name: 4-[(4-butoxy-3-methoxy-phenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Openeye Name: 4-[(4-butoxy-3-methoxy-phenyl)methylene]-1-(m-tolyl)pyrazolidine-3,5-dione CAS Name: 4-[(4-butoxy-3-methoxyphenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione IUPAC Name: 4-[(4-butoxy-3-methoxyphenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Traditional Name: 4-(4-butoxy-3-methoxy-benzylidene)-1-(m-tolyl)pyrazolidine-3,5-quinone Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4/c1-4-5-11-28-19-10-9-16(14-20(19)27-3)13-18-21(25)23-24(22(18)26)17-8-6-7-15(2)12-17/h6-10,12-14H,4-5,11H2,1-3H3,(H,23,25)