2,6-bis(fluoranyl)-4-(4-octylcyclohexa-1,3-dien-1-yl)benzenecarbonitrile

Systemtic Name: 2,6-bis(fluoranyl)-4-(4-octylcyclohexa-1,3-dien-1-yl)benzenecarbonitrile Openeye Name: 2,6-difluoro-4-(4-octylcyclohexa-1,3-dien-1-yl)benzonitrile CAS Name: 2,6-difluoro-4-(4-octyl-1-cyclohexa-1,3-dienyl)benzonitrile IUPAC Name: 2,6-difluoro-4-(4-octylcyclohexa-1,3-dien-1-yl)benzonitrile Traditional Name: 2,6-difluoro-4-(4-octylcyclohexa-1,3-dien-1-yl)benzonitrile Formula: C21H25F2N MolecularWeight: 329.426706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(CC1)C2=CC(=C(C(=C2)F)C#N)F

Isomeric SMILES

CCCCCCCCC1=CC=C(CC1)C2=CC(=C(C(=C2)F)C#N)F

InChI

InChI=1S/C21H25F2N/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)18-13-20(22)19(15-24)21(23)14-18/h9,11,13-14H,2-8,10,12H2,1H3