6,7-bis(fluoranyl)-5-heptoxy-2-(4-hexylphenyl)-1-benzothiophene

Systemtic Name: 6,7-bis(fluoranyl)-5-heptoxy-2-(4-hexylphenyl)-1-benzothiophene Openeye Name: 6,7-difluoro-5-heptoxy-2-(4-hexylphenyl)benzothiophene CAS Name: 6,7-difluoro-5-heptoxy-2-(4-hexylphenyl)-1-benzothiophene IUPAC Name: 6,7-difluoro-5-heptoxy-2-(4-hexylphenyl)-1-benzothiophene Traditional Name: 6,7-difluoro-5-heptoxy-2-(4-hexylphenyl)benzothiophene Formula: C27H34F2OS MolecularWeight: 444.620066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C(=C2C(=C1)C=C(S2)C3=CC=C(C=C3)CCCCCC)F)F

Isomeric SMILES

CCCCCCCOC1=C(C(=C2C(=C1)C=C(S2)C3=CC=C(C=C3)CCCCCC)F)F

InChI

InChI=1S/C27H34F2OS/c1-3-5-7-9-11-17-30-23-18-22-19-24(31-27(22)26(29)25(23)28)21-15-13-20(14-16-21)12-10-8-6-4-2/h13-16,18-19H,3-12,17H2,1-2H3