6-phenyl-5-[4-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulene

Systemtic Name: 6-phenyl-5-[4-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulene Openeye Name: 6-phenyl-5-[4-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulene CAS Name: 6-phenyl-5-[4-[5-[[4-(trifluoromethyl)phenyl]methylthio]pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulene IUPAC Name: 6-phenyl-5-[4-[5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulene Traditional Name: 6-phenyl-5-[4-[5-[[4-(trifluoromethyl)benzyl]thio]pentoxy]phenyl]-8,9-dihydro-7H-benzocycloheptene Formula: C36H35F3OS MolecularWeight: 572.72271

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C(=C(C1)C3=CC=CC=C3)C4=CC=C(C=C4)OCCCCCSCC5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

C1CC2=CC=CC=C2C(=C(C1)C3=CC=CC=C3)C4=CC=C(C=C4)OCCCCCSCC5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C36H35F3OS/c37-36(38,39)31-20-16-27(17-21-31)26-41-25-8-2-7-24-40-32-22-18-30(19-23-32)35-33-14-6-5-12-29(33)13-9-15-34(35)28-10-3-1-4-11-28/h1,3-6,10-12,14,16-23H,2,7-9,13,15,24-26H2