1-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-fluoranyl-4-pentyl-benzene

Systemtic Name: 1-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-fluoranyl-4-pentyl-benzene Openeye Name: 1-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-fluoro-4-pentyl-benzene CAS Name: 1-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-fluoro-4-pentylbenzene IUPAC Name: 1-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-fluoro-4-pentylbenzene Traditional Name: 4-amyl-1-[2-[4-(4-butylphenyl)cyclohexyl]ethynyl]-2-fluoro-benzene Formula: C29H37F MolecularWeight: 404.602483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CCCC)F

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CCCC)F

InChI

InChI=1S/C29H37F/c1-3-5-7-9-25-15-21-28(29(30)22-25)20-14-24-12-18-27(19-13-24)26-16-10-23(11-17-26)8-6-4-2/h10-11,15-17,21-22,24,27H,3-9,12-13,18-19H2,1-2H3