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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC4=CC5=C(C=C4)OCO5

InChI

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