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

Systemtic Name: 4-[[4-(1,3-benzodioxol-5-ylmethoxy)-3,5-dimethoxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[4-(1,3-benzodioxol-5-ylmethoxy)-3,5-dimethoxy-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethoxy)-3,5-dimethoxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[4-(1,3-benzodioxol-5-ylmethoxy)-3,5-dimethoxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3,5-dimethoxy-4-piperonyloxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C26H22N2O7 MolecularWeight: 474.46208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22N2O7/c1-31-22-12-17(10-19-25(29)27-28(26(19)30)18-6-4-3-5-7-18)13-23(32-2)24(22)33-14-16-8-9-20-21(11-16)35-15-34-20/h3-13H,14-15H2,1-2H3,(H,27,29)