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2-[[2-nitro-4-(trifluoromethyl)phenyl]-oxidanyl-methylidene]cyclohexane-1,3-dione

2-[[2-nitro-4-(trifluoromethyl)phenyl]-oxidanyl-methylidene]cyclohexane-1,3-dione

Systemtic Name:2-[[2-nitro-4-(trifluoromethyl)phenyl]-oxidanyl-methylidene]cyclohexane-1,3-dione
Openeye Name:2-[hydroxy-[2-nitro-4-(trifluoromethyl)phenyl]methylene]cyclohexane-1,3-dione
CAS Name:2-[hydroxy-[2-nitro-4-(trifluoromethyl)phenyl]methylidene]cyclohexane-1,3-dione
IUPAC Name:2-[hydroxy-[2-nitro-4-(trifluoromethyl)phenyl]methylidene]cyclohexane-1,3-dione
Traditional Name:2-[hydroxy-[2-nitro-4-(trifluoromethyl)phenyl]methylene]cyclohexane-1,3-quinone
Formula: C14H10F3NO5
MolecularWeight: 329.22811
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(=C(C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])O)C(=O)C1


Isomeric SMILES

C1CC(=O)C(=C(C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])O)C(=O)C1


InChI

InChI=1S/C14H10F3NO5/c15-14(16,17)7-4-5-8(9(6-7)18(22)23)13(21)12-10(19)2-1-3-11(12)20/h4-6,21H,1-3H2


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