2-(3,5-ditert-butyl-4-oxidanyl-phenyl)hexanedioate

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)hexanedioate Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)hexanedioate CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)hexanedioate IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)hexanedioate Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)adipate Formula: C20H28O5-2 MolecularWeight: 348.43332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(CCCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(CCCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H30O5/c1-19(2,3)14-10-12(11-15(17(14)23)20(4,5)6)13(18(24)25)8-7-9-16(21)22/h10-11,13,23H,7-9H2,1-6H3,(H,21,22)(H,24,25)/p-2