3-[4-(2-oxidanylidenepyrrolidin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-(2-oxidanylidenepyrrolidin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-(2-oxopyrrolidin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-(2-oxo-1-pyrrolidinyl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(2-oxopyrrolidin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(2-ketopyrrolidino)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C15H12F3N3O2 MolecularWeight: 323.26989

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C15H12F3N3O2/c16-15(17,18)10-8-9(11-4-6-13(22)20-19-11)3-5-12(10)21-7-1-2-14(21)23/h3-6,8H,1-2,7H2,(H,20,22)