2-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(2-chloro-6-fluoro-benzoyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(2-chloro-6-fluorophenyl)-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(2-chloro-6-fluorobenzoyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(2-chloro-6-fluoro-benzoyl)piperazino]isonicotinonitrile Formula: C17H14ClFN4O MolecularWeight: 344.770663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H14ClFN4O/c18-13-2-1-3-14(19)16(13)17(24)23-8-6-22(7-9-23)15-10-12(11-20)4-5-21-15/h1-5,10H,6-9H2