3-tert-butyl-5-octyl-4-oxidanyl-benzoic acid

Systemtic Name: 3-tert-butyl-5-octyl-4-oxidanyl-benzoic acid Openeye Name: 3-tert-butyl-4-hydroxy-5-octyl-benzoic acid CAS Name: 3-tert-butyl-4-hydroxy-5-octylbenzoic acid IUPAC Name: 3-tert-butyl-4-hydroxy-5-octylbenzoic acid Traditional Name: 3-tert-butyl-4-hydroxy-5-octyl-benzoic acid Formula: C19H30O3 MolecularWeight: 306.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=CC(=C1)C(=O)O)C(C)(C)C)O

Isomeric SMILES

CCCCCCCCC1=C(C(=CC(=C1)C(=O)O)C(C)(C)C)O

InChI

InChI=1S/C19H30O3/c1-5-6-7-8-9-10-11-14-12-15(18(21)22)13-16(17(14)20)19(2,3)4/h12-13,20H,5-11H2,1-4H3,(H,21,22)