2-(5-chloranyl-2-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]propanenitrile

Systemtic Name: 2-(5-chloranyl-2-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]propanenitrile Openeye Name: 2-(5-chloro-2-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]propanenitrile CAS Name: 2-(5-chloro-2-nitrophenyl)-3-[3-(trifluoromethyl)phenyl]propanenitrile IUPAC Name: 2-(5-chloro-2-nitrophenyl)-3-[3-(trifluoromethyl)phenyl]propanenitrile Traditional Name: 2-(5-chloro-2-nitro-phenyl)-3-[3-(trifluoromethyl)phenyl]propionitrile Formula: C16H10ClF3N2O2 MolecularWeight: 354.71101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClF3N2O2/c17-13-4-5-15(22(23)24)14(8-13)11(9-21)6-10-2-1-3-12(7-10)16(18,19)20/h1-5,7-8,11H,6H2