3-chloranyl-2-[3-nitro-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 3-chloranyl-2-[3-nitro-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 3-chloro-2-[3-nitro-2-oxo-5-(trifluoromethyl)-1-pyridyl]-5-(trifluoromethyl)benzonitrile CAS Name: 3-chloro-2-[3-nitro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-5-(trifluoromethyl)benzonitrile IUPAC Name: 3-chloro-2-[3-nitro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-5-(trifluoromethyl)benzonitrile Traditional Name: 3-chloro-2-[2-keto-3-nitro-5-(trifluoromethyl)-1-pyridyl]-5-(trifluoromethyl)benzonitrile Formula: C14H4ClF6N3O3 MolecularWeight: 411.643279

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C=C(C=C(C2=O)[N+](=O)[O-])C(F)(F)F)C#N)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C=C(C=C(C2=O)[N+](=O)[O-])C(F)(F)F)C#N)C(F)(F)F

InChI

InChI=1S/C14H4ClF6N3O3/c15-9-2-7(13(16,17)18)1-6(4-22)11(9)23-5-8(14(19,20)21)3-10(12(23)25)24(26)27/h1-3,5H