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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCC

InChI

InChI=1S/C20H19BrN2O4/c1-3-26-17-11-13(16(21)12-18(17)27-4-2)10-15-19(24)22-23(20(15)25)14-8-6-5-7-9-14/h5-12H,3-4H2,1-2H3,(H,22,24)