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

Systemtic Name: 4-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylidene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione Openeye Name: 4-[(3-ethoxy-4-prop-2-ynoxy-phenyl)methylene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione CAS Name: 4-[(3-ethoxy-4-prop-2-ynoxyphenyl)methylidene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione IUPAC Name: 4-[(3-ethoxy-4-prop-2-ynoxyphenyl)methylidene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione Traditional Name: 4-(3-ethoxy-4-propargyloxy-benzylidene)-1-(4-fluorophenyl)pyrazolidine-3,5-quinone Formula: C21H17FN2O4 MolecularWeight: 380.369083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)F)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)F)OCC#C

InChI

InChI=1S/C21H17FN2O4/c1-3-11-28-18-10-5-14(13-19(18)27-4-2)12-17-20(25)23-24(21(17)26)16-8-6-15(22)7-9-16/h1,5-10,12-13H,4,11H2,2H3,(H,23,25)