6-(4-hydroxyphenyl)-5-[4-[5-[4,4,5,5,5-pentakis(fluoranyl)pentylsulfanyl]pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol

Systemtic Name: 6-(4-hydroxyphenyl)-5-[4-[5-[4,4,5,5,5-pentakis(fluoranyl)pentylsulfanyl]pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol Openeye Name: 6-(4-hydroxyphenyl)-5-[4-[5-(4,4,5,5,5-pentafluoropentylsulfanyl)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol CAS Name: 6-(4-hydroxyphenyl)-5-[4-[5-(4,4,5,5,5-pentafluoropentylthio)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol IUPAC Name: 6-(4-hydroxyphenyl)-5-[4-[5-(4,4,5,5,5-pentafluoropentylsulfanyl)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol Traditional Name: 6-(4-hydroxyphenyl)-5-[4-[5-(4,4,5,5,5-pentafluoropentylthio)pentoxy]phenyl]-8,9-dihydro-7H-benzocyclohepten-2-ol Formula: C33H35F5O3S MolecularWeight: 606.686216

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)O)C(=C(C1)C3=CC=C(C=C3)O)C4=CC=C(C=C4)OCCCCCSCCCC(C(F)(F)F)(F)F

Isomeric SMILES

C1CC2=C(C=CC(=C2)O)C(=C(C1)C3=CC=C(C=C3)O)C4=CC=C(C=C4)OCCCCCSCCCC(C(F)(F)F)(F)F

InChI

InChI=1S/C33H35F5O3S/c34-32(35,33(36,37)38)18-5-21-42-20-3-1-2-19-41-28-15-10-24(11-16-28)31-29(23-8-12-26(39)13-9-23)7-4-6-25-22-27(40)14-17-30(25)31/h8-17,22,39-40H,1-7,18-21H2