2-[2-(4-tert-butylphenoxy)-1-oxidanyl-ethyl]-1-benzofuran-5-carboxylic acid

Systemtic Name: 2-[2-(4-tert-butylphenoxy)-1-oxidanyl-ethyl]-1-benzofuran-5-carboxylic acid Openeye Name: 2-[2-(4-tert-butylphenoxy)-1-hydroxy-ethyl]benzofuran-5-carboxylic acid CAS Name: 2-[2-(4-tert-butylphenoxy)-1-hydroxyethyl]-5-benzofurancarboxylic acid IUPAC Name: 2-[2-(4-tert-butylphenoxy)-1-hydroxyethyl]-1-benzofuran-5-carboxylic acid Traditional Name: 2-[2-(4-tert-butylphenoxy)-1-hydroxy-ethyl]benzofuran-5-carboxylic acid Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(C2=CC3=C(O2)C=CC(=C3)C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(C2=CC3=C(O2)C=CC(=C3)C(=O)O)O

InChI

InChI=1S/C21H22O5/c1-21(2,3)15-5-7-16(8-6-15)25-12-17(22)19-11-14-10-13(20(23)24)4-9-18(14)26-19/h4-11,17,22H,12H2,1-3H3,(H,23,24)