2,6-ditert-butyl-4,4-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4,4-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4,4-bis[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4,4-bis[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4,4-bis[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4,4-bis(3,5-ditert-butyl-4-hydroxy-benzyl)cyclohexa-2,5-dien-1-one Formula: C44H66O3 MolecularWeight: 642.99304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2(C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2(C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C44H66O3/c1-38(2,3)29-19-27(20-30(35(29)45)39(4,5)6)23-44(25-33(42(13,14)15)37(47)34(26-44)43(16,17)18)24-28-21-31(40(7,8)9)36(46)32(22-28)41(10,11)12/h19-22,25-26,45-46H,23-24H2,1-18H3