4-[6,8-bis(fluoranyl)-7-heptyl-9,10-dihydrophenanthren-2-yl]benzenecarbonitrile

Systemtic Name: 4-[6,8-bis(fluoranyl)-7-heptyl-9,10-dihydrophenanthren-2-yl]benzenecarbonitrile Openeye Name: 4-(6,8-difluoro-7-heptyl-9,10-dihydrophenanthren-2-yl)benzonitrile CAS Name: 4-(6,8-difluoro-7-heptyl-9,10-dihydrophenanthren-2-yl)benzonitrile IUPAC Name: 4-(6,8-difluoro-7-heptyl-9,10-dihydrophenanthren-2-yl)benzonitrile Traditional Name: 4-(6,8-difluoro-7-heptyl-9,10-dihydrophenanthren-2-yl)benzonitrile Formula: C28H27F2N MolecularWeight: 415.517486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C=C2C(=C1F)CCC3=C2C=CC(=C3)C4=CC=C(C=C4)C#N)F

Isomeric SMILES

CCCCCCCC1=C(C=C2C(=C1F)CCC3=C2C=CC(=C3)C4=CC=C(C=C4)C#N)F

InChI

InChI=1S/C28H27F2N/c1-2-3-4-5-6-7-25-27(29)17-26-23-14-12-21(20-10-8-19(18-31)9-11-20)16-22(23)13-15-24(26)28(25)30/h8-12,14,16-17H,2-7,13,15H2,1H3