(4E)-4-[[3-bromanyl-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4E)-4-[[3-bromanyl-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[[3-bromo-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[[3-bromo-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[[3-bromo-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-[3-bromo-5-ethoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C27H25BrN2O6 MolecularWeight: 553.4012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCOC4=CC=C(C=C4)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCOC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H25BrN2O6/c1-3-34-24-17-18(15-22-26(31)29-30(27(22)32)19-7-5-4-6-8-19)16-23(28)25(24)36-14-13-35-21-11-9-20(33-2)10-12-21/h4-12,15-17H,3,13-14H2,1-2H3,(H,29,31)/b22-15+