bis[4-(2-methylheptan-2-yl)phenyl] 2,2-bis[(5-tert-butyl-2,3-dimethyl-4-oxidanyl-phenyl)methyl]propanedioate

Systemtic Name: bis[4-(2-methylheptan-2-yl)phenyl] 2,2-bis[(5-tert-butyl-2,3-dimethyl-4-oxidanyl-phenyl)methyl]propanedioate Openeye Name: bis[4-(1,1-dimethylhexyl)phenyl] 2,2-bis[(5-tert-butyl-4-hydroxy-2,3-dimethyl-phenyl)methyl]propanedioate CAS Name: 2,2-bis[(5-tert-butyl-4-hydroxy-2,3-dimethylphenyl)methyl]propanedioic acid bis[4-(2-methylheptan-2-yl)phenyl] ester IUPAC Name: bis[4-(2-methylheptan-2-yl)phenyl] 2,2-bis[(5-tert-butyl-4-hydroxy-2,3-dimethylphenyl)methyl]propanedioate Traditional Name: 2,2-bis(5-tert-butyl-4-hydroxy-2,3-dimethyl-benzyl)malonic acid bis[4-(1,1-dimethylhexyl)phenyl] ester Formula: C57H80O6 MolecularWeight: 861.2415

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC=C(C=C1)OC(=O)C(CC2=CC(=C(C(=C2C)C)O)C(C)(C)C)(CC3=CC(=C(C(=C3C)C)O)C(C)(C)C)C(=O)OC4=CC=C(C=C4)C(C)(C)CCCCC

Isomeric SMILES

CCCCCC(C)(C)C1=CC=C(C=C1)OC(=O)C(CC2=CC(=C(C(=C2C)C)O)C(C)(C)C)(CC3=CC(=C(C(=C3C)C)O)C(C)(C)C)C(=O)OC4=CC=C(C=C4)C(C)(C)CCCCC

InChI

InChI=1S/C57H80O6/c1-17-19-21-31-55(13,14)43-23-27-45(28-24-43)62-51(60)57(35-41-33-47(53(7,8)9)49(58)39(5)37(41)3,36-42-34-48(54(10,11)12)50(59)40(6)38(42)4)52(61)63-46-29-25-44(26-30-46)56(15,16)32-22-20-18-2/h23-30,33-34,58-59H,17-22,31-32,35-36H2,1-16H3