2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(4-fluorobenzoyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-fluorobenzoyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(4-fluorobenzoyl)piperazino]nicotinonitrile Formula: C17H15FN4O MolecularWeight: 310.325603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)C#N)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)C#N)C(=O)C3=CC=C(C=C3)F

InChI

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