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4-[6,8-bis(fluoranyl)-7-heptyl-5,6,7,8-tetrahydrophenanthren-2-yl]benzenecarbonitrile

4-[6,8-bis(fluoranyl)-7-heptyl-5,6,7,8-tetrahydrophenanthren-2-yl]benzenecarbonitrile

Systemtic Name:4-[6,8-bis(fluoranyl)-7-heptyl-5,6,7,8-tetrahydrophenanthren-2-yl]benzenecarbonitrile
Openeye Name:4-(6,8-difluoro-7-heptyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile
CAS Name:4-(6,8-difluoro-7-heptyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile
IUPAC Name:4-(6,8-difluoro-7-heptyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile
Traditional Name:4-(6,8-difluoro-7-heptyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile
Formula: C28H29F2N
MolecularWeight: 417.533366
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(CC2=C(C1F)C=CC3=C2C=CC(=C3)C4=CC=C(C=C4)C#N)F


Isomeric SMILES

CCCCCCCC1C(CC2=C(C1F)C=CC3=C2C=CC(=C3)C4=CC=C(C=C4)C#N)F


InChI

InChI=1S/C28H29F2N/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/h8-16,25,27-28H,2-7,17H2,1H3


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