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

Systemtic Name: 4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]-5-prop-2-enyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-allyl-5-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[3-allyl-5-ethoxy-4-(2-fluorobenzyl)oxy-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C28H25FN2O4 MolecularWeight: 472.507503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=CC=C2F)CC=C)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=CC=C2F)CC=C)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C28H25FN2O4/c1-3-10-20-15-19(16-23-27(32)30-31(28(23)33)22-12-6-5-7-13-22)17-25(34-4-2)26(20)35-18-21-11-8-9-14-24(21)29/h3,5-9,11-17H,1,4,10,18H2,2H3,(H,30,32)