2-fluoranyl-4-(8-fluoranyl-7-hexyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-(8-fluoranyl-7-hexyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzenecarbonitrile Openeye Name: 2-fluoro-4-(8-fluoro-7-hexyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile CAS Name: 2-fluoro-4-(8-fluoro-7-hexyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile IUPAC Name: 2-fluoro-4-(8-fluoro-7-hexyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile Traditional Name: 2-fluoro-4-(8-fluoro-7-hexyl-5,6,7,8-tetrahydrophenanthren-2-yl)benzonitrile Formula: C27H27F2N MolecularWeight: 403.506786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC2=C(C1F)C=CC3=C2C=CC(=C3)C4=CC(=C(C=C4)C#N)F

Isomeric SMILES

CCCCCCC1CCC2=C(C1F)C=CC3=C2C=CC(=C3)C4=CC(=C(C=C4)C#N)F

InChI

InChI=1S/C27H27F2N/c1-2-3-4-5-6-18-9-13-24-23-12-10-19(15-21(23)11-14-25(24)27(18)29)20-7-8-22(17-30)26(28)16-20/h7-8,10-12,14-16,18,27H,2-6,9,13H2,1H3