(4E)-4-[(3,4-dimethoxyphenyl)methylidene]-5-morpholin-4-yl-2-(4-nitrophenyl)pyrazol-3-one

Systemtic Name: (4E)-4-[(3,4-dimethoxyphenyl)methylidene]-5-morpholin-4-yl-2-(4-nitrophenyl)pyrazol-3-one Openeye Name: (4E)-4-[(3,4-dimethoxyphenyl)methylene]-5-morpholino-2-(4-nitrophenyl)pyrazol-3-one CAS Name: (4E)-4-[(3,4-dimethoxyphenyl)methylidene]-5-(4-morpholinyl)-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: (4E)-4-[(3,4-dimethoxyphenyl)methylidene]-5-morpholin-4-yl-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: (4E)-5-morpholino-2-(4-nitrophenyl)-4-veratrylidene-2-pyrazolin-3-one Formula: C22H22N4O6 MolecularWeight: 438.43328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])N4CCOCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])N4CCOCC4)OC

InChI

InChI=1S/C22H22N4O6/c1-30-19-8-3-15(14-20(19)31-2)13-18-21(24-9-11-32-12-10-24)23-25(22(18)27)16-4-6-17(7-5-16)26(28)29/h3-8,13-14H,9-12H2,1-2H3/b18-13+