(4E)-4-[[(4-methoxyphenyl)methylamino]methylidene]-3-(trifluoromethyl)-1H-pyrazol-5-one

Systemtic Name: (4E)-4-[[(4-methoxyphenyl)methylamino]methylidene]-3-(trifluoromethyl)-1H-pyrazol-5-one Openeye Name: (4E)-4-[[(4-methoxyphenyl)methylamino]methylene]-3-(trifluoromethyl)-1H-pyrazol-5-one CAS Name: (4E)-4-[[(4-methoxyphenyl)methylamino]methylidene]-3-(trifluoromethyl)-1H-pyrazol-5-one IUPAC Name: (4E)-4-[[(4-methoxyphenyl)methylamino]methylidene]-3-(trifluoromethyl)-1H-pyrazol-5-one Traditional Name: (4E)-4-[(p-anisylamino)methylene]-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C13H12F3N3O2 MolecularWeight: 299.24849

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC=C2C(=NNC2=O)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)CN/C=C/2\C(=NNC2=O)C(F)(F)F

InChI

InChI=1S/C13H12F3N3O2/c1-21-9-4-2-8(3-5-9)6-17-7-10-11(13(14,15)16)18-19-12(10)20/h2-5,7,17H,6H2,1H3,(H,19,20)/b10-7+