2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-2-methyl-undecanoate

Systemtic Name: 2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-2-methyl-undecanoate Openeye Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-2-methyl-undecanoate CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-methylundecanoate IUPAC Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-methylundecanoate Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-benzyl)-2-methyl-undecanoate Formula: C27H45O3- MolecularWeight: 417.6444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCC(C)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C27H46O3/c1-9-10-11-12-13-14-15-16-27(8,24(29)30)19-20-17-21(25(2,3)4)23(28)22(18-20)26(5,6)7/h17-18,28H,9-16,19H2,1-8H3,(H,29,30)/p-1