2,6-ditert-butyl-4-[2-decyl-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-4-(sulfanylmethyl)hexadecyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[2-decyl-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-4-(sulfanylmethyl)hexadecyl]phenol Openeye Name: 2,6-ditert-butyl-4-[2-decyl-2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-4-(sulfanylmethyl)hexadecyl]phenol CAS Name: 2,6-ditert-butyl-4-[2-decyl-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-4-(mercaptomethyl)hexadecyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[2-decyl-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-4-(sulfanylmethyl)hexadecyl]phenol Traditional Name: 2,6-ditert-butyl-4-[2-decyl-2-(3,5-ditert-butyl-4-hydroxy-benzyl)-4-(mercaptomethyl)hexadecyl]phenol Formula: C56H98O2S MolecularWeight: 835.44112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC(CCCCCCCCCC)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)CS

Isomeric SMILES

CCCCCCCCCCCCC(CC(CCCCCCCCCC)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)CS

InChI

InChI=1S/C56H98O2S/c1-15-17-19-21-23-25-26-27-29-31-33-43(42-59)39-56(34-32-30-28-24-22-20-18-16-2,40-44-35-46(52(3,4)5)50(57)47(36-44)53(6,7)8)41-45-37-48(54(9,10)11)51(58)49(38-45)55(12,13)14/h35-38,43,57-59H,15-34,39-42H2,1-14H3