4-(pyridin-2-ylmethyliminomethyl)-3-(trifluoromethyl)-1,4-dihydropyrazol-5-one

Systemtic Name: 4-(pyridin-2-ylmethyliminomethyl)-3-(trifluoromethyl)-1,4-dihydropyrazol-5-one Openeye Name: 4-(2-pyridylmethyliminomethyl)-3-(trifluoromethyl)-1,4-dihydropyrazol-5-one CAS Name: 4-(2-pyridinylmethyliminomethyl)-3-(trifluoromethyl)-1,4-dihydropyrazol-5-one IUPAC Name: 4-(pyridin-2-ylmethyliminomethyl)-3-(trifluoromethyl)-1,4-dihydropyrazol-5-one Traditional Name: 4-(2-pyridylmethyliminomethyl)-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C11H9F3N4O MolecularWeight: 270.21057

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9F3N4O/c12-11(13,14)9-8(10(19)18-17-9)6-15-5-7-3-1-2-4-16-7/h1-4,6,8H,5H2,(H,18,19)