4-[[5-bromanyl-2-[3-(4-chloranylphenoxy)propoxy]phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[5-bromanyl-2-[3-(4-chloranylphenoxy)propoxy]phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[5-bromo-2-[3-(4-chlorophenoxy)propoxy]phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[5-bromo-2-[3-(4-chlorophenoxy)propoxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[5-bromo-2-[3-(4-chlorophenoxy)propoxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[5-bromo-2-[3-(4-chlorophenoxy)propoxy]benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C25H20BrClN2O4 MolecularWeight: 527.7943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)Br)OCCCOC4=CC=C(C=C4)Cl)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)Br)OCCCOC4=CC=C(C=C4)Cl)C(=O)N2

InChI

InChI=1S/C25H20BrClN2O4/c26-18-7-12-23(33-14-4-13-32-21-10-8-19(27)9-11-21)17(15-18)16-22-24(30)28-29(25(22)31)20-5-2-1-3-6-20/h1-3,5-12,15-16H,4,13-14H2,(H,28,30)