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

Systemtic Name: 4-[6-[bis(fluoranyl)methyl]-5-chloranyl-pyrimidin-4-yl]-5-fluoranyl-2-nitro-benzenecarbonitrile Openeye Name: 4-[5-chloro-6-(difluoromethyl)pyrimidin-4-yl]-5-fluoro-2-nitro-benzonitrile CAS Name: 4-[5-chloro-6-(difluoromethyl)-4-pyrimidinyl]-5-fluoro-2-nitrobenzonitrile IUPAC Name: 4-[5-chloro-6-(difluoromethyl)pyrimidin-4-yl]-5-fluoro-2-nitrobenzonitrile Traditional Name: 4-[5-chloro-6-(difluoromethyl)pyrimidin-4-yl]-5-fluoro-2-nitro-benzonitrile Formula: C12H4ClF3N4O2 MolecularWeight: 328.63397

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H4ClF3N4O2/c13-9-10(18-4-19-11(9)12(15)16)6-2-8(20(21)22)5(3-17)1-7(6)14/h1-2,4,12H