2-fluoranyl-6-(4-pyridin-4-ylcarbonylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-(4-pyridin-4-ylcarbonylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-(4-isonicotinoylpiperazino)benzonitrile Formula: C17H15FN4O MolecularWeight: 310.325603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15FN4O/c18-15-2-1-3-16(14(15)12-19)21-8-10-22(11-9-21)17(23)13-4-6-20-7-5-13/h1-7H,8-11H2