4-[[3-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[3-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-(2-morpholino-2-oxo-ethoxy)phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[3-(2-keto-2-morpholino-ethoxy)benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C22H21N3O5 MolecularWeight: 407.41924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC2=CC=CC(=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=O)COC2=CC=CC(=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O5/c26-20(24-9-11-29-12-10-24)15-30-18-8-4-5-16(13-18)14-19-21(27)23-25(22(19)28)17-6-2-1-3-7-17/h1-8,13-14H,9-12,15H2,(H,23,27)