1,3-bis(fluoranyl)-5-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-2-methyl-benzene

Systemtic Name: 1,3-bis(fluoranyl)-5-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-2-methyl-benzene Openeye Name: 1,3-difluoro-5-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-2-methyl-benzene CAS Name: 1,3-difluoro-5-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-2-methylbenzene IUPAC Name: 1,3-difluoro-5-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-2-methylbenzene Traditional Name: 1,3-difluoro-5-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-2-methyl-benzene Formula: C28H30F2 MolecularWeight: 404.534606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=CC(=C(C(=C3)F)C)F

Isomeric SMILES

CCCCC#CCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=CC(=C(C(=C3)F)C)F

InChI

InChI=1S/C28H30F2/c1-3-4-5-6-7-8-22-11-15-25(16-12-22)26-17-13-23(14-18-26)9-10-24-19-27(29)21(2)28(30)20-24/h13-14,17-20,22,25H,3-5,8,11-12,15-16H2,1-2H3