2-fluoranyl-6-[4-(3-nitropyridin-2-yl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-(3-nitropyridin-2-yl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(3-nitro-2-pyridyl)piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-(3-nitro-2-pyridinyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(3-nitropyridin-2-yl)piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-(3-nitro-2-pyridyl)piperazino]benzonitrile Formula: C16H14FN5O2 MolecularWeight: 327.313063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H14FN5O2/c17-13-3-1-4-14(12(13)11-18)20-7-9-21(10-8-20)16-15(22(23)24)5-2-6-19-16/h1-6H,7-10H2