4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-methoxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-methoxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-methoxy-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-methoxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-methoxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-methoxy-2-piperonyloxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C25H20N2O6 MolecularWeight: 444.4361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC3=C(C=C2)OCO3)C=C4C(=O)NN(C4=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC3=C(C=C2)OCO3)C=C4C(=O)NN(C4=O)C5=CC=CC=C5

InChI

InChI=1S/C25H20N2O6/c1-30-21-9-5-6-17(23(21)31-14-16-10-11-20-22(12-16)33-15-32-20)13-19-24(28)26-27(25(19)29)18-7-3-2-4-8-18/h2-13H,14-15H2,1H3,(H,26,28)