2,6-bis(fluoranyl)-4-pentan-2-yl-benzenecarbonitrile

Systemtic Name: 2,6-bis(fluoranyl)-4-pentan-2-yl-benzenecarbonitrile Openeye Name: 2,6-difluoro-4-(1-methylbutyl)benzonitrile CAS Name: 2,6-difluoro-4-pentan-2-ylbenzonitrile IUPAC Name: 2,6-difluoro-4-pentan-2-ylbenzonitrile Traditional Name: 2,6-difluoro-4-(1-methylbutyl)benzonitrile Formula: C12H13F2N MolecularWeight: 209.235126

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC(=C(C(=C1)F)C#N)F

Isomeric SMILES

CCCC(C)C1=CC(=C(C(=C1)F)C#N)F

InChI

InChI=1S/C12H13F2N/c1-3-4-8(2)9-5-11(13)10(7-15)12(14)6-9/h5-6,8H,3-4H2,1-2H3