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

Systemtic Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoranyl-1-propyl-benzene Openeye Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-1-propyl-benzene CAS Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-1-propylbenzene IUPAC Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-1-propylbenzene Traditional Name: 4-[2-[4-(4-but-2-ynylcyclohexyl)phenyl]ethynyl]-2-fluoro-1-propyl-benzene Formula: C27H29F MolecularWeight: 372.517563

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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#CC)F

Isomeric SMILES

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

InChI

InChI=1S/C27H29F/c1-3-5-7-21-10-15-24(16-11-21)25-17-12-22(13-18-25)8-9-23-14-19-26(6-4-2)27(28)20-23/h12-14,17-21,24H,4,6-7,10-11,15-16H2,1-2H3