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

Systemtic Name: 4-[6,8-bis(fluoranyl)-7-hexyl-9,10-dihydrophenanthren-2-yl]benzenecarbonitrile Openeye Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)benzonitrile CAS Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)benzonitrile IUPAC Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)benzonitrile Traditional Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)benzonitrile Formula: C27H25F2N MolecularWeight: 401.490906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1F)CCC3=C2C=CC(=C3)C4=CC=C(C=C4)C#N)F

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1F)CCC3=C2C=CC(=C3)C4=CC=C(C=C4)C#N)F

InChI

InChI=1S/C27H25F2N/c1-2-3-4-5-6-24-26(28)16-25-22-13-11-20(19-9-7-18(17-30)8-10-19)15-21(22)12-14-23(25)27(24)29/h7-11,13,15-16H,2-6,12,14H2,1H3