4-[5-chloranyl-6-(trifluoromethyl)pyrimidin-4-yl]-5-fluoranyl-2-nitro-benzenecarbonitrile

Systemtic Name: 4-[5-chloranyl-6-(trifluoromethyl)pyrimidin-4-yl]-5-fluoranyl-2-nitro-benzenecarbonitrile Openeye Name: 4-[5-chloro-6-(trifluoromethyl)pyrimidin-4-yl]-5-fluoro-2-nitro-benzonitrile CAS Name: 4-[5-chloro-6-(trifluoromethyl)-4-pyrimidinyl]-5-fluoro-2-nitrobenzonitrile IUPAC Name: 4-[5-chloro-6-(trifluoromethyl)pyrimidin-4-yl]-5-fluoro-2-nitrobenzonitrile Traditional Name: 4-[5-chloro-6-(trifluoromethyl)pyrimidin-4-yl]-5-fluoro-2-nitro-benzonitrile Formula: C12H3ClF4N4O2 MolecularWeight: 346.624433

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1F)C2=C(C(=NC=N2)C(F)(F)F)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1=C(C(=CC(=C1F)C2=C(C(=NC=N2)C(F)(F)F)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H3ClF4N4O2/c13-9-10(19-4-20-11(9)12(15,16)17)6-2-8(21(22)23)5(3-18)1-7(6)14/h1-2,4H