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

Systemtic Name: 4-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]benzonitrile CAS Name: 4-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]benzonitrile Traditional Name: 4-[4-[2-(trifluoromethyl)benzoyl]piperazino]benzonitrile Formula: C19H16F3N3O MolecularWeight: 359.34505

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H16F3N3O/c20-19(21,22)17-4-2-1-3-16(17)18(26)25-11-9-24(10-12-25)15-7-5-14(13-23)6-8-15/h1-8H,9-12H2