2-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]ethanenitrile Openeye Name: 2-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]acetonitrile CAS Name: 2-[4-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]acetonitrile Traditional Name: 2-[4-[4-(trifluoromethyl)benzoyl]piperazino]acetonitrile Formula: C14H14F3N3O MolecularWeight: 297.27567

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC#N)C(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C14H14F3N3O/c15-14(16,17)12-3-1-11(2-4-12)13(21)20-9-7-19(6-5-18)8-10-20/h1-4H,6-10H2