2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]acetonitrile CAS Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]acetonitrile Traditional Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazino]acetonitrile Formula: C12H12ClF3N4 MolecularWeight: 304.69869

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1CC#N)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C12H12ClF3N4/c13-10-7-9(12(14,15)16)8-18-11(10)20-5-3-19(2-1-17)4-6-20/h7-8H,2-6H2