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

Systemtic Name: (4E)-4-[[3-methoxy-2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[3-methoxy-2-[(4-nitrophenyl)methoxy]phenyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[3-methoxy-2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[3-methoxy-2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[3-methoxy-2-(4-nitrobenzyl)oxy-benzylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21N3O5/c1-17-22(25(29)27(26-17)20-8-4-3-5-9-20)15-19-7-6-10-23(32-2)24(19)33-16-18-11-13-21(14-12-18)28(30)31/h3-15H,16H2,1-2H3/b22-15+