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

Systemtic Name: (4E)-4-[[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[2-[(4-chlorophenyl)methoxy]-5-nitro-phenyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[2-[(4-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[2-[(4-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[2-(4-chlorobenzyl)oxy-5-nitro-benzylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C24H18ClN3O4 MolecularWeight: 447.87042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=C(C=CC(=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H18ClN3O4/c1-16-22(24(29)27(26-16)20-5-3-2-4-6-20)14-18-13-21(28(30)31)11-12-23(18)32-15-17-7-9-19(25)10-8-17/h2-14H,15H2,1H3/b22-14+