2,9-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)-2,9-dimethyl-decanedioic acid

Systemtic Name: 2,9-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)-2,9-dimethyl-decanedioic acid Openeye Name: 2,9-bis(3,5-ditert-butyl-4-hydroxy-phenyl)-2,9-dimethyl-decanedioic acid CAS Name: 2,9-bis(3,5-ditert-butyl-4-hydroxyphenyl)-2,9-dimethyldecanedioic acid IUPAC Name: 2,9-bis(3,5-ditert-butyl-4-hydroxyphenyl)-2,9-dimethyldecanedioic acid Traditional Name: 2,9-bis(3,5-ditert-butyl-4-hydroxy-phenyl)-2,9-dimethyl-sebacic acid Formula: C40H62O6 MolecularWeight: 638.91668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H62O6/c1-35(2,3)27-21-25(22-28(31(27)41)36(4,5)6)39(13,33(43)44)19-17-15-16-18-20-40(14,34(45)46)26-23-29(37(7,8)9)32(42)30(24-26)38(10,11)12/h21-24,41-42H,15-20H2,1-14H3,(H,43,44)(H,45,46)