4-[[3-(trifluoromethyl)phenyl]methyliminomethyl]-1,4-dihydropyrazol-5-one

Systemtic Name: 4-[[3-(trifluoromethyl)phenyl]methyliminomethyl]-1,4-dihydropyrazol-5-one Openeye Name: 4-[[3-(trifluoromethyl)phenyl]methyliminomethyl]-1,4-dihydropyrazol-5-one CAS Name: 4-[[3-(trifluoromethyl)phenyl]methyliminomethyl]-1,4-dihydropyrazol-5-one IUPAC Name: 4-[[3-(trifluoromethyl)phenyl]methyliminomethyl]-1,4-dihydropyrazol-5-one Traditional Name: 4-[[3-(trifluoromethyl)benzyl]iminomethyl]-2-pyrazolin-3-one Formula: C12H10F3N3O MolecularWeight: 269.22251

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CN=CC2C=NNC2=O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CN=CC2C=NNC2=O

InChI

InChI=1S/C12H10F3N3O/c13-12(14,15)10-3-1-2-8(4-10)5-16-6-9-7-17-18-11(9)19/h1-4,6-7,9H,5H2,(H,18,19)