2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazino]nicotinonitrile Formula: C18H17FN4O MolecularWeight: 324.352183

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=C(C=CC=N3)C#N)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=C(C=CC=N3)C#N)F

InChI

InChI=1S/C18H17FN4O/c1-13(24)14-4-5-17(16(19)11-14)22-7-9-23(10-8-22)18-15(12-20)3-2-6-21-18/h2-6,11H,7-10H2,1H3