1,3-bis[[2,6-bis(2,6-dimethylphenyl)phenyl]methyl]-5-tert-butyl-2-oxidanylsulfanyl-benzene

Systemtic Name: 1,3-bis[[2,6-bis(2,6-dimethylphenyl)phenyl]methyl]-5-tert-butyl-2-oxidanylsulfanyl-benzene Openeye Name: 1,3-bis[[2,6-bis(2,6-dimethylphenyl)phenyl]methyl]-5-tert-butyl-2-hydroxysulfanyl-benzene CAS Name: 2,6-bis[[2,6-bis(2,6-dimethylphenyl)phenyl]methyl]-4-tert-butylbenzenesulfenic acid IUPAC Name: 1,3-bis[[2,6-bis(2,6-dimethylphenyl)phenyl]methyl]-5-tert-butyl-2-hydroxysulfanylbenzene Traditional Name: 1,3-bis[2,6-bis(2,6-dimethylphenyl)benzyl]-5-tert-butyl-2-sulfeno-benzene Formula: C56H58OS MolecularWeight: 779.12412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=C(C(=CC=C2)C3=C(C=CC=C3C)C)CC4=CC(=CC(=C4SO)CC5=C(C=CC=C5C6=C(C=CC=C6C)C)C7=C(C=CC=C7C)C)C(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=C(C(=CC=C2)C3=C(C=CC=C3C)C)CC4=CC(=CC(=C4SO)CC5=C(C=CC=C5C6=C(C=CC=C6C)C)C7=C(C=CC=C7C)C)C(C)(C)C

InChI

InChI=1S/C56H58OS/c1-34-18-12-19-35(2)51(34)45-26-16-27-46(52-36(3)20-13-21-37(52)4)49(45)32-42-30-44(56(9,10)11)31-43(55(42)58-57)33-50-47(53-38(5)22-14-23-39(53)6)28-17-29-48(50)54-40(7)24-15-25-41(54)8/h12-31,57H,32-33H2,1-11H3