6-azanyl-2-[2-methoxy-5-(trifluoromethyl)phenyl]-5-nitroso-1H-pyrimidin-4-one

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(F)(F)F)C2=NC(=O)C(=C(N2)N)N=O

Isomeric SMILES

COC1=C(C=C(C=C1)C(F)(F)F)C2=NC(=O)C(=C(N2)N)N=O

InChI

InChI=1S/C12H9F3N4O3/c1-22-7-3-2-5(12(13,14)15)4-6(7)10-17-9(16)8(19-21)11(20)18-10/h2-4H,1H3,(H3,16,17,18,20)