2-[4-(4-but-3-enylphenyl)-3,5-bis(fluoranyl)phenyl]-1-fluoranyl-6-heptyl-naphthalene

Systemtic Name: 2-[4-(4-but-3-enylphenyl)-3,5-bis(fluoranyl)phenyl]-1-fluoranyl-6-heptyl-naphthalene Openeye Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluoro-phenyl]-1-fluoro-6-heptyl-naphthalene CAS Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluorophenyl]-1-fluoro-6-heptylnaphthalene IUPAC Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluorophenyl]-1-fluoro-6-heptylnaphthalene Traditional Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluoro-phenyl]-1-fluoro-6-heptyl-naphthalene Formula: C33H33F3 MolecularWeight: 486.61033

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C(C=C1)C(=C(C=C2)C3=CC(=C(C(=C3)F)C4=CC=C(C=C4)CCC=C)F)F

Isomeric SMILES

CCCCCCCC1=CC2=C(C=C1)C(=C(C=C2)C3=CC(=C(C(=C3)F)C4=CC=C(C=C4)CCC=C)F)F

InChI

InChI=1S/C33H33F3/c1-3-5-7-8-9-11-24-14-18-28-26(20-24)17-19-29(33(28)36)27-21-30(34)32(31(35)22-27)25-15-12-23(13-16-25)10-6-4-2/h4,12-22H,2-3,5-11H2,1H3