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

Systemtic Name: 4-(phenylmethyl)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one Openeye Name: 4-benzyl-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one CAS Name: 4-(phenylmethyl)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-benzyl-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-benzyl-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C11H9F3N2O MolecularWeight: 242.19717

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(NNC2=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(NNC2=O)C(F)(F)F

InChI

InChI=1S/C11H9F3N2O/c12-11(13,14)9-8(10(17)16-15-9)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,15,16,17)