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

Systemtic Name: (4E)-5-methyl-4-[[2-[(4-methylphenyl)methoxy]-5-nitro-phenyl]methylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4E)-5-methyl-4-[[5-nitro-2-(p-tolylmethoxy)phenyl]methylene]-2-phenyl-pyrazol-3-one CAS Name: (4E)-5-methyl-4-[[2-[(4-methylphenyl)methoxy]-5-nitrophenyl]methylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4E)-5-methyl-4-[[2-[(4-methylphenyl)methoxy]-5-nitrophenyl]methylidene]-2-phenylpyrazol-3-one Traditional Name: (4E)-5-methyl-4-[2-(4-methylbenzyl)oxy-5-nitro-benzylidene]-2-phenyl-2-pyrazolin-3-one Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])C=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])/C=C/3\C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H21N3O4/c1-17-8-10-19(11-9-17)16-32-24-13-12-22(28(30)31)14-20(24)15-23-18(2)26-27(25(23)29)21-6-4-3-5-7-21/h3-15H,16H2,1-2H3/b23-15+