4-[3,4,4-tris(fluoranyl)but-3-enylsulfonyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[3,4,4-tris(fluoranyl)but-3-enylsulfonyl]-1,2-dihydropyrazol-3-one Openeye Name: 4-(3,4,4-trifluorobut-3-enylsulfonyl)-1,2-dihydropyrazol-3-one CAS Name: 4-(3,4,4-trifluorobut-3-enylsulfonyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-(3,4,4-trifluorobut-3-enylsulfonyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-(3,4,4-trifluorobut-3-enylsulfonyl)-3-pyrazolin-3-one Formula: C7H7F3N2O3S MolecularWeight: 256.20229

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NN1)S(=O)(=O)CCC(=C(F)F)F

Isomeric SMILES

C1=C(C(=O)NN1)S(=O)(=O)CCC(=C(F)F)F

InChI

InChI=1S/C7H7F3N2O3S/c8-4(6(9)10)1-2-16(14,15)5-3-11-12-7(5)13/h3H,1-2H2,(H2,11,12,13)