2-pentadecylsulfanyl-5-(2,4,4-trimethylpentan-2-yl)benzene-1,4-diol

Systemtic Name: 2-pentadecylsulfanyl-5-(2,4,4-trimethylpentan-2-yl)benzene-1,4-diol Openeye Name: 2-pentadecylsulfanyl-5-(1,1,3,3-tetramethylbutyl)benzene-1,4-diol CAS Name: 2-(pentadecylthio)-5-(2,4,4-trimethylpentan-2-yl)benzene-1,4-diol IUPAC Name: 2-pentadecylsulfanyl-5-(2,4,4-trimethylpentan-2-yl)benzene-1,4-diol Traditional Name: 2-(pentadecylthio)-5-(1,1,3,3-tetramethylbutyl)hydroquinone Formula: C29H52O2S MolecularWeight: 464.78698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCSC1=C(C=C(C(=C1)O)C(C)(C)CC(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCSC1=C(C=C(C(=C1)O)C(C)(C)CC(C)(C)C)O

InChI

InChI=1S/C29H52O2S/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-32-27-22-25(30)24(21-26(27)31)29(5,6)23-28(2,3)4/h21-22,30-31H,7-20,23H2,1-6H3