(4E)-4-[(3-ethoxy-4-phenylmethoxy-phenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(3-ethoxy-4-phenylmethoxy-phenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-benzyloxy-3-ethoxy-phenyl)methylene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one CAS Name: (4E)-4-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one Traditional Name: (4E)-4-(4-benzoxy-3-ethoxy-benzylidene)-2-(4-nitrophenyl)-5-phenyl-2-pyrazolin-3-one Formula: C31H25N3O5 MolecularWeight: 519.5473

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C31H25N3O5/c1-2-38-29-20-23(13-18-28(29)39-21-22-9-5-3-6-10-22)19-27-30(24-11-7-4-8-12-24)32-33(31(27)35)25-14-16-26(17-15-25)34(36)37/h3-20H,2,21H2,1H3/b27-19+