4-[[3-ethoxy-4-[(2-methylpropan-2-yl)oxy]-5-prop-2-enyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[3-ethoxy-4-[(2-methylpropan-2-yl)oxy]-5-prop-2-enyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(3-allyl-4-tert-butoxy-5-ethoxy-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-ethoxy-4-[(2-methylpropan-2-yl)oxy]-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-ethoxy-4-[(2-methylpropan-2-yl)oxy]-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-allyl-4-tert-butoxy-5-ethoxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OC(C)(C)C)CC=C)C=C2C(=O)NN(C2=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OC(C)(C)C)CC=C)C=C2C(=O)NN(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O4/c1-6-11-18-14-17(16-21(30-7-2)22(18)31-25(3,4)5)15-20-23(28)26-27(24(20)29)19-12-9-8-10-13-19/h6,8-10,12-16H,1,7,11H2,2-5H3,(H,26,28)