2-fluoranyl-4-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-1-methyl-benzene

Systemtic Name: 2-fluoranyl-4-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-1-methyl-benzene Openeye Name: 2-fluoro-4-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-1-methyl-benzene CAS Name: 2-fluoro-4-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-1-methylbenzene IUPAC Name: 2-fluoro-4-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-1-methylbenzene Traditional Name: 2-fluoro-4-[2-[4-(4-hept-2-ynylcyclohexyl)phenyl]ethynyl]-1-methyl-benzene Formula: C28H31F MolecularWeight: 386.544143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31F/c1-3-4-5-6-7-8-23-13-17-26(18-14-23)27-19-15-24(16-20-27)11-12-25-10-9-22(2)28(29)21-25/h9-10,15-16,19-21,23,26H,3-5,8,13-14,17-18H2,1-2H3