2-(4-fluorophenyl)-2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)ethanenitrile

Systemtic Name: 2-(4-fluorophenyl)-2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)ethanenitrile Openeye Name: 2-(4-fluorophenyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-yl]acetonitrile CAS Name: 2-(4-fluorophenyl)-2-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-(4-fluorophenyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(4-fluorophenyl)-2-(4-nicotinoylpiperazino)acetonitrile Formula: C18H17FN4O MolecularWeight: 324.352183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C#N)C2=CC=C(C=C2)F)C(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1C(C#N)C2=CC=C(C=C2)F)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H17FN4O/c19-16-5-3-14(4-6-16)17(12-20)22-8-10-23(11-9-22)18(24)15-2-1-7-21-13-15/h1-7,13,17H,8-11H2