(4E)-4-[[5-nitro-2-(2-phenoxyethoxy)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4E)-4-[[5-nitro-2-(2-phenoxyethoxy)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[[5-nitro-2-(2-phenoxyethoxy)phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[[5-nitro-2-(2-phenoxyethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[[5-nitro-2-(2-phenoxyethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-[5-nitro-2-(2-phenoxyethoxy)benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C24H19N3O6 MolecularWeight: 445.42416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])OCCOC4=CC=CC=C4)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])OCCOC4=CC=CC=C4)/C(=O)N2

InChI

InChI=1S/C24H19N3O6/c28-23-21(24(29)26(25-23)18-7-3-1-4-8-18)16-17-15-19(27(30)31)11-12-22(17)33-14-13-32-20-9-5-2-6-10-20/h1-12,15-16H,13-14H2,(H,25,28)/b21-16+