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5-nitro-4-oxidanyl-2-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]-1H-pyrimidin-6-one
5-nitro-4-oxidanyl-2-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]-1H-pyrimidin-6-one
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC(=C1)C(F)(F)F)C=CC2=NC(=C(C(=O)N2)[N+](=O)[O-])O
Isomeric SMILES
C1=CC(=CC(=C1)C(F)(F)F)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])O
InChI
InChI=1S/C13H8F3N3O4/c14-13(15,16)8-3-1-2-7(6-8)4-5-9-17-11(20)10(19(22)23)12(21)18-9/h1-6H,(H2,17,18,20,21)/b5-4+
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