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

Systemtic Name: 2-[4-(4-but-3-enylphenyl)-3,5-bis(fluoranyl)phenyl]-6-heptyl-naphthalene Openeye Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluoro-phenyl]-6-heptyl-naphthalene CAS Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluorophenyl]-6-heptylnaphthalene IUPAC Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluorophenyl]-6-heptylnaphthalene Traditional Name: 2-[4-(4-but-3-enylphenyl)-3,5-difluoro-phenyl]-6-heptyl-naphthalene Formula: C33H34F2 MolecularWeight: 468.619866

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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

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

InChI

InChI=1S/C33H34F2/c1-3-5-7-8-9-11-25-14-17-28-21-29(19-18-27(28)20-25)30-22-31(34)33(32(35)23-30)26-15-12-24(13-16-26)10-6-4-2/h4,12-23H,2-3,5-11H2,1H3