2-fluoranyl-6-[4-(5-nitropyridin-2-yl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-(5-nitropyridin-2-yl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(5-nitro-2-pyridyl)piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-(5-nitro-2-pyridinyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(5-nitropyridin-2-yl)piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-(5-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=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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