4-fluoranyl-3-[(2-oxidanylidenepyrimidin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[(2-oxidanylidenepyrimidin-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[(2-oxopyrimidin-1-yl)methyl]benzonitrile CAS Name: 4-fluoro-3-[(2-oxo-1-pyrimidinyl)methyl]benzonitrile IUPAC Name: 4-fluoro-3-[(2-oxopyrimidin-1-yl)methyl]benzonitrile Traditional Name: 4-fluoro-3-[(2-ketopyrimidin-1-yl)methyl]benzonitrile Formula: C12H8FN3O MolecularWeight: 229.209823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1)CC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

C1=CN(C(=O)N=C1)CC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C12H8FN3O/c13-11-3-2-9(7-14)6-10(11)8-16-5-1-4-15-12(16)17/h1-6H,8H2