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

Systemtic Name: (4E)-4-[[3-chloranyl-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: (4E)-4-[[3-chloro-4-[(4-nitrophenyl)methoxy]phenyl]methylene]-2-phenyl-5-propyl-pyrazol-3-one CAS Name: (4E)-4-[[3-chloro-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: (4E)-4-[[3-chloro-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-2-phenyl-5-propylpyrazol-3-one Traditional Name: (4E)-4-[3-chloro-4-(4-nitrobenzyl)oxy-benzylidene]-2-phenyl-5-propyl-2-pyrazolin-3-one Formula: C26H22ClN3O4 MolecularWeight: 475.92358

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C26H22ClN3O4/c1-2-6-24-22(26(31)29(28-24)20-7-4-3-5-8-20)15-19-11-14-25(23(27)16-19)34-17-18-9-12-21(13-10-18)30(32)33/h3-5,7-16H,2,6,17H2,1H3/b22-15+