6-azanyl-5-nitroso-2-[2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-5-nitroso-2-[2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-5-nitroso-2-[2-(2,2,2-trifluoroethoxy)phenyl]-1H-pyrimidin-4-one CAS Name: 6-amino-5-nitroso-2-[2-(2,2,2-trifluoroethoxy)phenyl]-1H-pyrimidin-4-one IUPAC Name: 6-amino-5-nitroso-2-[2-(2,2,2-trifluoroethoxy)phenyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-5-nitroso-2-[2-(2,2,2-trifluoroethoxy)phenyl]-1H-pyrimidin-4-one Formula: C12H9F3N4O3 MolecularWeight: 314.22007

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=O)C(=C(N2)N)N=O)OCC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=O)C(=C(N2)N)N=O)OCC(F)(F)F

InChI

InChI=1S/C12H9F3N4O3/c13-12(14,15)5-22-7-4-2-1-3-6(7)10-17-9(16)8(19-21)11(20)18-10/h1-4H,5H2,(H3,16,17,18,20)