(4E)-4-[(2-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4E)-4-[(2-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[(2-bromo-4-isopropoxy-5-methoxy-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[(2-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[(2-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-(2-bromo-4-isopropoxy-5-methoxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C(=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C(=C1)Br)/C=C/2\C(=O)NN(C2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H19BrN2O4/c1-12(2)27-18-11-16(21)13(10-17(18)26-3)9-15-19(24)22-23(20(15)25)14-7-5-4-6-8-14/h4-12H,1-3H3,(H,22,24)/b15-9+