2-fluoranyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]benzonitrile Formula: C18H14F4N4O2 MolecularWeight: 394.322973

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H14F4N4O2/c19-14-2-1-3-15(13(14)11-23)24-6-8-25(9-7-24)16-5-4-12(18(20,21)22)10-17(16)26(27)28/h1-5,10H,6-9H2