(4E)-4-[[3-(4-phenylmethoxyphenyl)-1,2-oxazol-5-yl]methylidene]pyrazolidin-3-one

Systemtic Name: (4E)-4-[[3-(4-phenylmethoxyphenyl)-1,2-oxazol-5-yl]methylidene]pyrazolidin-3-one Openeye Name: (4E)-4-[[3-(4-benzyloxyphenyl)isoxazol-5-yl]methylene]pyrazolidin-3-one CAS Name: (4E)-4-[[3-(4-phenylmethoxyphenyl)-5-isoxazolyl]methylidene]-3-pyrazolidinone IUPAC Name: (4E)-4-[[3-(4-phenylmethoxyphenyl)-1,2-oxazol-5-yl]methylidene]pyrazolidin-3-one Traditional Name: (4E)-4-[[3-(4-benzoxyphenyl)isoxazol-5-yl]methylene]pyrazolidin-3-one Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC(=NO2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)NN1

Isomeric SMILES

C1/C(=C\C2=CC(=NO2)C3=CC=C(C=C3)OCC4=CC=CC=C4)/C(=O)NN1

InChI

InChI=1S/C20H17N3O3/c24-20-16(12-21-22-20)10-18-11-19(23-26-18)15-6-8-17(9-7-15)25-13-14-4-2-1-3-5-14/h1-11,21H,12-13H2,(H,22,24)/b16-10+