4-(6-fluoranylisoquinolin-3-yl)butanenitrile

Systemtic Name: 4-(6-fluoranylisoquinolin-3-yl)butanenitrile Openeye Name: 4-(6-fluoro-3-isoquinolyl)butanenitrile CAS Name: 4-(6-fluoro-3-isoquinolinyl)butanenitrile IUPAC Name: 4-(6-fluoroisoquinolin-3-yl)butanenitrile Traditional Name: 4-(6-fluoro-3-isoquinolyl)butyronitrile Formula: C13H11FN2 MolecularWeight: 214.238243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CN=C(C=C2C=C1F)CCCC#N

Isomeric SMILES

C1=CC2=CN=C(C=C2C=C1F)CCCC#N

InChI

InChI=1S/C13H11FN2/c14-12-5-4-10-9-16-13(3-1-2-6-15)8-11(10)7-12/h4-5,7-9H,1-3H2