2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(3,4-dimethoxyphenyl)ethanenitrile

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(3,4-dimethoxyphenyl)ethanenitrile Openeye Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-(3,4-dimethoxyphenyl)acetonitrile CAS Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-(3,4-dimethoxyphenyl)acetonitrile IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(3,4-dimethoxyphenyl)acetonitrile Traditional Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-(3,4-dimethoxyphenyl)acetonitrile Formula: C16H12ClF3N2O2 MolecularWeight: 356.72689

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)C2=C(C=C(C=N2)C(F)(F)F)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)C2=C(C=C(C=N2)C(F)(F)F)Cl)OC

InChI

InChI=1S/C16H12ClF3N2O2/c1-23-13-4-3-9(5-14(13)24-2)11(7-21)15-12(17)6-10(8-22-15)16(18,19)20/h3-6,8,11H,1-2H3