2,3-bis(fluoranyl)-1-[2-fluoranyl-4-(4-prop-2-enoxycyclohexyl)phenyl]-4-hexyl-benzene

Systemtic Name: 2,3-bis(fluoranyl)-1-[2-fluoranyl-4-(4-prop-2-enoxycyclohexyl)phenyl]-4-hexyl-benzene Openeye Name: 1-[4-(4-allyloxycyclohexyl)-2-fluoro-phenyl]-2,3-difluoro-4-hexyl-benzene CAS Name: 2,3-difluoro-1-[2-fluoro-4-(4-prop-2-enoxycyclohexyl)phenyl]-4-hexylbenzene IUPAC Name: 2,3-difluoro-1-[2-fluoro-4-(4-prop-2-enoxycyclohexyl)phenyl]-4-hexylbenzene Traditional Name: 1-[4-(4-allyloxycyclohexyl)-2-fluoro-phenyl]-2,3-difluoro-4-hexyl-benzene Formula: C27H33F3O MolecularWeight: 430.54553

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C=C1)C2=C(C=C(C=C2)C3CCC(CC3)OCC=C)F)F)F

Isomeric SMILES

CCCCCCC1=C(C(=C(C=C1)C2=C(C=C(C=C2)C3CCC(CC3)OCC=C)F)F)F

InChI

InChI=1S/C27H33F3O/c1-3-5-6-7-8-20-11-16-24(27(30)26(20)29)23-15-12-21(18-25(23)28)19-9-13-22(14-10-19)31-17-4-2/h4,11-12,15-16,18-19,22H,2-3,5-10,13-14,17H2,1H3