(4E)-4-[[5-bromanyl-2-(2-methylprop-2-enoxy)phenyl]methylidene]-5-methylidene-2-phenyl-pyrazolidin-3-one

Systemtic Name: (4E)-4-[[5-bromanyl-2-(2-methylprop-2-enoxy)phenyl]methylidene]-5-methylidene-2-phenyl-pyrazolidin-3-one Openeye Name: (4E)-4-[[5-bromo-2-(2-methylallyloxy)phenyl]methylene]-5-methylene-2-phenyl-pyrazolidin-3-one CAS Name: (4E)-4-[[5-bromo-2-(2-methylprop-2-enoxy)phenyl]methylidene]-5-methylene-2-phenyl-3-pyrazolidinone IUPAC Name: (4E)-4-[[5-bromo-2-(2-methylprop-2-enoxy)phenyl]methylidene]-5-methylidene-2-phenylpyrazolidin-3-one Traditional Name: (4E)-4-[5-bromo-2-(2-methylallyloxy)benzylidene]-5-methylene-2-phenyl-pyrazolidin-3-one Formula: C21H19BrN2O2 MolecularWeight: 411.29176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN2O2/c1-14(2)13-26-20-10-9-17(22)11-16(20)12-19-15(3)23-24(21(19)25)18-7-5-4-6-8-18/h4-12,23H,1,3,13H2,2H3/b19-12+