(4Z)-4-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)pyrazol-3-one

Systemtic Name: (4Z)-4-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)pyrazol-3-one Openeye Name: (4Z)-4-[(2-bromo-4,5-dimethoxy-phenyl)methylene]-5-ethoxy-2-(4-nitrophenyl)pyrazol-3-one CAS Name: (4Z)-4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: (4Z)-4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: (4Z)-4-(2-bromo-4,5-dimethoxy-benzylidene)-5-ethoxy-2-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C20H18BrN3O6 MolecularWeight: 476.27742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=O)C1=CC2=CC(=C(C=C2Br)OC)OC)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC\1=NN(C(=O)/C1=C\C2=CC(=C(C=C2Br)OC)OC)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18BrN3O6/c1-4-30-19-15(9-12-10-17(28-2)18(29-3)11-16(12)21)20(25)23(22-19)13-5-7-14(8-6-13)24(26)27/h5-11H,4H2,1-3H3/b15-9-