(4Z)-4-[[3-bromanyl-5-methoxy-4-(3-phenoxypropoxy)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4Z)-4-[[3-bromanyl-5-methoxy-4-(3-phenoxypropoxy)phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4Z)-4-[[3-bromo-5-methoxy-4-(3-phenoxypropoxy)phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4Z)-4-[[3-bromo-5-methoxy-4-(3-phenoxypropoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4Z)-4-[[3-bromo-5-methoxy-4-(3-phenoxypropoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4Z)-4-[3-bromo-5-methoxy-4-(3-phenoxypropoxy)benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C26H23BrN2O5 MolecularWeight: 523.37522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCCOC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCCOC4=CC=CC=C4

InChI

InChI=1S/C26H23BrN2O5/c1-32-23-17-18(15-21-25(30)28-29(26(21)31)19-9-4-2-5-10-19)16-22(27)24(23)34-14-8-13-33-20-11-6-3-7-12-20/h2-7,9-12,15-17H,8,13-14H2,1H3,(H,28,30)/b21-15-