4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoranyl-1-propyl-benzene

Systemtic Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoranyl-1-propyl-benzene Openeye Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoro-1-propyl-benzene CAS Name: 4-[4-[2-[4-(4-ethylcyclohexyl)-1-cyclohexenyl]ethynyl]phenyl]-2-fluoro-1-propylbenzene IUPAC Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoro-1-propylbenzene Traditional Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoro-1-propyl-benzene Formula: C31H37F MolecularWeight: 428.623883

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C2=CC=C(C=C2)C#CC3=CCC(CC3)C4CCC(CC4)CC)F

Isomeric SMILES

CCCC1=C(C=C(C=C1)C2=CC=C(C=C2)C#CC3=CCC(CC3)C4CCC(CC4)CC)F

InChI

InChI=1S/C31H37F/c1-3-5-29-20-21-30(22-31(29)32)28-18-12-25(13-19-28)7-6-24-10-16-27(17-11-24)26-14-8-23(4-2)9-15-26/h10,12-13,18-23,26-27H,3-5,8-9,11,14-17H2,1-2H3