1,7-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl]-5-methyl-5-oxidanyl-heptan-3-one

Systemtic Name: 1,7-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl]-5-methyl-5-oxidanyl-heptan-3-one Openeye Name: 1,7-bis[(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl]-5-hydroxy-5-methyl-heptan-3-one CAS Name: 1,7-bis[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-5-hydroxy-5-methyl-3-heptanone IUPAC Name: 1,7-bis[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl]-5-hydroxy-5-methylheptan-3-one Traditional Name: 1,7-bis[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-5-hydroxy-5-methyl-heptan-3-one Formula: C36H56O4S2 MolecularWeight: 616.95744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCCC(=O)CC(C)(CCSC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCCC(=O)CC(C)(CCSC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)O

InChI

InChI=1S/C36H56O4S2/c1-32(2,3)26-18-24(19-27(30(26)38)33(4,5)6)41-16-14-23(37)22-36(13,40)15-17-42-25-20-28(34(7,8)9)31(39)29(21-25)35(10,11)12/h18-21,38-40H,14-17,22H2,1-13H3