(4E)-4-[(4,5-dimethoxy-2-nitro-phenyl)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one

Systemtic Name: (4E)-4-[(4,5-dimethoxy-2-nitro-phenyl)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Openeye Name: (4E)-4-[(4,5-dimethoxy-2-nitro-phenyl)methylene]-5-methyl-2-(p-tolyl)pyrazol-3-one CAS Name: (4E)-4-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-5-methyl-2-(4-methylphenyl)-3-pyrazolone IUPAC Name: (4E)-4-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Traditional Name: (4E)-4-(4,5-dimethoxy-2-nitro-benzylidene)-5-methyl-2-(p-tolyl)-2-pyrazolin-3-one Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)/C(=N2)C

InChI

InChI=1S/C20H19N3O5/c1-12-5-7-15(8-6-12)22-20(24)16(13(2)21-22)9-14-10-18(27-3)19(28-4)11-17(14)23(25)26/h5-11H,1-4H3/b16-9+