2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfonyl-2-methyl-octanoic acid

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfonyl-2-methyl-octanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfonyl-2-methyl-octanoic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfonyl-2-methyloctanoic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfonyl-2-methyloctanoic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfonyl-2-methyl-caprylic acid Formula: C23H38O5S MolecularWeight: 426.60982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C(=O)O)S(=O)(=O)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCC(C)(C(=O)O)S(=O)(=O)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C23H38O5S/c1-9-10-11-12-13-23(8,20(25)26)29(27,28)16-14-17(21(2,3)4)19(24)18(15-16)22(5,6)7/h14-15,24H,9-13H2,1-8H3,(H,25,26)