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

Systemtic Name: (4E)-4-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-(4-benzoxy-3-bromo-5-methoxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C24H19BrN2O4 MolecularWeight: 479.32266

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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)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/2\C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C24H19BrN2O4/c1-30-21-14-17(13-20(25)22(21)31-15-16-8-4-2-5-9-16)12-19-23(28)26-27(24(19)29)18-10-6-3-7-11-18/h2-14H,15H2,1H3,(H,26,28)/b19-12+