5-tert-butyl-2-[4-tert-butyl-2-carboxy-6-(2-oxidanylpropan-2-yl)phenyl]sulfanyl-3-(2-oxidanylpropan-2-yl)benzoic acid

Systemtic Name: 5-tert-butyl-2-[4-tert-butyl-2-carboxy-6-(2-oxidanylpropan-2-yl)phenyl]sulfanyl-3-(2-oxidanylpropan-2-yl)benzoic acid Openeye Name: 5-tert-butyl-2-[4-tert-butyl-2-carboxy-6-(1-hydroxy-1-methyl-ethyl)phenyl]sulfanyl-3-(1-hydroxy-1-methyl-ethyl)benzoic acid CAS Name: 5-tert-butyl-2-[[4-tert-butyl-2-carboxy-6-(2-hydroxypropan-2-yl)phenyl]thio]-3-(2-hydroxypropan-2-yl)benzoic acid IUPAC Name: 5-tert-butyl-2-[4-tert-butyl-2-carboxy-6-(2-hydroxypropan-2-yl)phenyl]sulfanyl-3-(2-hydroxypropan-2-yl)benzoic acid Traditional Name: 5-tert-butyl-2-[[4-tert-butyl-2-carboxy-6-(1-hydroxy-1-methyl-ethyl)phenyl]thio]-3-(1-hydroxy-1-methyl-ethyl)benzoic acid Formula: C28H38O6S MolecularWeight: 502.66272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)SC2=C(C=C(C=C2C(=O)O)C(C)(C)C)C(C)(C)O)C(C)(C)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)SC2=C(C=C(C=C2C(=O)O)C(C)(C)C)C(C)(C)O)C(C)(C)O

InChI

InChI=1S/C28H38O6S/c1-25(2,3)15-11-17(23(29)30)21(19(13-15)27(7,8)33)35-22-18(24(31)32)12-16(26(4,5)6)14-20(22)28(9,10)34/h11-14,33-34H,1-10H3,(H,29,30)(H,31,32)