4-(4-chloranylpyrazol-1-yl)-3-oxidanylidene-2-[3-(trifluoromethyloxy)phenyl]butanenitrile

Systemtic Name: 4-(4-chloranylpyrazol-1-yl)-3-oxidanylidene-2-[3-(trifluoromethyloxy)phenyl]butanenitrile Openeye Name: 4-(4-chloropyrazol-1-yl)-3-oxo-2-[3-(trifluoromethoxy)phenyl]butanenitrile CAS Name: 4-(4-chloro-1-pyrazolyl)-3-oxo-2-[3-(trifluoromethoxy)phenyl]butanenitrile IUPAC Name: 4-(4-chloropyrazol-1-yl)-3-oxo-2-[3-(trifluoromethoxy)phenyl]butanenitrile Traditional Name: 4-(4-chloropyrazol-1-yl)-3-keto-2-[3-(trifluoromethoxy)phenyl]butyronitrile Formula: C14H9ClF3N3O2 MolecularWeight: 343.68837

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)C(C#N)C(=O)CN2C=C(C=N2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)C(C#N)C(=O)CN2C=C(C=N2)Cl

InChI

InChI=1S/C14H9ClF3N3O2/c15-10-6-20-21(7-10)8-13(22)12(5-19)9-2-1-3-11(4-9)23-14(16,17)18/h1-4,6-7,12H,8H2