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

Systemtic Name: 4-[4-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoranyl-1-propyl-benzene Openeye Name: 4-[4-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoro-1-propyl-benzene CAS Name: 4-[4-[2-[4-(4-butylcyclohexyl)-1-cyclohexenyl]ethynyl]phenyl]-2-fluoro-1-propylbenzene IUPAC Name: 4-[4-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoro-1-propylbenzene Traditional Name: 4-[4-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]-2-fluoro-1-propyl-benzene Formula: C33H41F MolecularWeight: 456.677043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C4=CC(=C(C=C4)CCC)F

Isomeric SMILES

CCCCC1CCC(CC1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C4=CC(=C(C=C4)CCC)F

InChI

InChI=1S/C33H41F/c1-3-5-7-25-10-16-28(17-11-25)29-18-12-26(13-19-29)8-9-27-14-20-30(21-15-27)32-23-22-31(6-4-2)33(34)24-32/h12,14-15,20-25,28-29H,3-7,10-11,13,16-19H2,1-2H3