2-[3,5-bis(trifluoromethyl)phenyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[3,5-bis(trifluoromethyl)phenyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one Openeye Name: 2-[3,5-bis(trifluoromethyl)phenyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one CAS Name: 2-[3,5-bis(trifluoromethyl)phenyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one Traditional Name: 2-[3,5-bis(trifluoromethyl)phenyl]-6-(trifluoromethyl)-1H-pyrimidin-4-one Formula: C13H5F9N2O MolecularWeight: 376.177229

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NC(=O)C=C(N2)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NC(=O)C=C(N2)C(F)(F)F

InChI

InChI=1S/C13H5F9N2O/c14-11(15,16)6-1-5(2-7(3-6)12(17,18)19)10-23-8(13(20,21)22)4-9(25)24-10/h1-4H,(H,23,24,25)