3-butan-2-yl-5-tert-butyl-2-oxidanyl-benzoic acid

Systemtic Name: 3-butan-2-yl-5-tert-butyl-2-oxidanyl-benzoic acid Openeye Name: 5-tert-butyl-2-hydroxy-3-sec-butyl-benzoic acid CAS Name: 3-butan-2-yl-5-tert-butyl-2-hydroxybenzoic acid IUPAC Name: 3-butan-2-yl-5-tert-butyl-2-hydroxybenzoic acid Traditional Name: 5-tert-butyl-2-hydroxy-3-sec-butyl-benzoic acid Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C(=CC(=C1)C(C)(C)C)C(=O)O)O

Isomeric SMILES

CCC(C)C1=C(C(=CC(=C1)C(C)(C)C)C(=O)O)O

InChI

InChI=1S/C15H22O3/c1-6-9(2)11-7-10(15(3,4)5)8-12(13(11)16)14(17)18/h7-9,16H,6H2,1-5H3,(H,17,18)