2,2-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyl]decanedioic acid

Systemtic Name: 2,2-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyl]decanedioic acid Openeye Name: 2,2-bis(3,5-ditert-butyl-4-hydroxy-benzoyl)decanedioic acid CAS Name: 2,2-bis[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethyl]decanedioic acid IUPAC Name: 2,2-bis(3,5-ditert-butyl-4-hydroxybenzoyl)decanedioic acid Traditional Name: 2,2-bis(3,5-ditert-butyl-4-hydroxy-benzoyl)sebacic acid Formula: C40H58O8 MolecularWeight: 666.88372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C(CCCCCCCC(=O)O)(C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C(CCCCCCCC(=O)O)(C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C40H58O8/c1-36(2,3)26-20-24(21-27(31(26)43)37(4,5)6)33(45)40(35(47)48,19-17-15-13-14-16-18-30(41)42)34(46)25-22-28(38(7,8)9)32(44)29(23-25)39(10,11)12/h20-23,43-44H,13-19H2,1-12H3,(H,41,42)(H,47,48)