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

Systemtic Name: 4-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-ethoxy-5-prop-2-enyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-allyl-4-(1,3-benzodioxol-5-ylmethoxy)-5-ethoxy-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-ethoxy-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-ethoxy-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-allyl-5-ethoxy-4-piperonyloxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C29H26N2O6 MolecularWeight: 498.52654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC3=C(C=C2)OCO3)CC=C)C=C4C(=O)NN(C4=O)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC3=C(C=C2)OCO3)CC=C)C=C4C(=O)NN(C4=O)C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O6/c1-3-8-21-13-20(14-23-28(32)30-31(29(23)33)22-9-6-5-7-10-22)16-26(34-4-2)27(21)35-17-19-11-12-24-25(15-19)37-18-36-24/h3,5-7,9-16H,1,4,8,17-18H2,2H3,(H,30,32)