2-fluoranyl-4-[2-[4-(4-pent-2-ynylcyclohexyl)phenyl]ethynyl]-1-propyl-benzene

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)C3CCC(CC3)CC#CCC)F

Isomeric SMILES

CCCC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)C3CCC(CC3)CC#CCC)F

InChI

InChI=1S/C28H31F/c1-3-5-6-8-22-11-16-25(17-12-22)26-18-13-23(14-19-26)9-10-24-15-20-27(7-4-2)28(29)21-24/h13-15,18-22,25H,3-4,7-8,11-12,16-17H2,1-2H3