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

Systemtic Name: (4E)-4-[[3-chloranyl-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[3-chloro-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[3-chloro-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[3-chloro-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[3-chloro-5-methoxy-4-(4-nitrobenzyl)oxy-benzylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C25H20ClN3O5 MolecularWeight: 477.8964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20ClN3O5/c1-16-21(25(30)28(27-16)19-6-4-3-5-7-19)12-18-13-22(26)24(23(14-18)33-2)34-15-17-8-10-20(11-9-17)29(31)32/h3-14H,15H2,1-2H3/b21-12+