3,5-ditert-butyl-2-hexyl-4-oxidanyl-benzoic acid

Systemtic Name: 3,5-ditert-butyl-2-hexyl-4-oxidanyl-benzoic acid Openeye Name: 3,5-ditert-butyl-2-hexyl-4-hydroxy-benzoic acid CAS Name: 3,5-ditert-butyl-2-hexyl-4-hydroxybenzoic acid IUPAC Name: 3,5-ditert-butyl-2-hexyl-4-hydroxybenzoic acid Traditional Name: 3,5-ditert-butyl-2-hexyl-4-hydroxy-benzoic acid Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C=C1C(=O)O)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCC1=C(C(=C(C=C1C(=O)O)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C21H34O3/c1-8-9-10-11-12-14-15(19(23)24)13-16(20(2,3)4)18(22)17(14)21(5,6)7/h13,22H,8-12H2,1-7H3,(H,23,24)