2,5-bis[(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)methyl]-3-methyl-hexanedioic acid

Systemtic Name: 2,5-bis[(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)methyl]-3-methyl-hexanedioic acid Openeye Name: 2,5-bis[(3-tert-butyl-4-hydroxy-5-methyl-phenyl)methyl]-3-methyl-hexanedioic acid CAS Name: 2,5-bis[(3-tert-butyl-4-hydroxy-5-methylphenyl)methyl]-3-methylhexanedioic acid IUPAC Name: 2,5-bis[(3-tert-butyl-4-hydroxy-5-methylphenyl)methyl]-3-methylhexanedioic acid Traditional Name: 2,5-bis(3-tert-butyl-4-hydroxy-5-methyl-benzyl)-3-methyl-adipic acid Formula: C31H44O6 MolecularWeight: 512.67746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(CC(C)C(CC2=CC(=C(C(=C2)C(C)(C)C)O)C)C(=O)O)C(=O)O)C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CC(CC(C)C(CC2=CC(=C(C(=C2)C(C)(C)C)O)C)C(=O)O)C(=O)O)C(C)(C)C)O

InChI

InChI=1S/C31H44O6/c1-17(23(29(36)37)14-21-11-19(3)27(33)25(16-21)31(7,8)9)12-22(28(34)35)13-20-10-18(2)26(32)24(15-20)30(4,5)6/h10-11,15-17,22-23,32-33H,12-14H2,1-9H3,(H,34,35)(H,36,37)