3-[(4-tert-butylphenoxy)methyl]-5-(4-ethanoylphenyl)-2-oxidanyl-benzoic acid

Systemtic Name: 3-[(4-tert-butylphenoxy)methyl]-5-(4-ethanoylphenyl)-2-oxidanyl-benzoic acid Openeye Name: 5-(4-acetylphenyl)-3-[(4-tert-butylphenoxy)methyl]-2-hydroxy-benzoic acid CAS Name: 5-(4-acetylphenyl)-3-[(4-tert-butylphenoxy)methyl]-2-hydroxybenzoic acid IUPAC Name: 5-(4-acetylphenyl)-3-[(4-tert-butylphenoxy)methyl]-2-hydroxybenzoic acid Traditional Name: 5-(4-acetylphenyl)-3-[(4-tert-butylphenoxy)methyl]-2-hydroxy-benzoic acid Formula: C26H26O5 MolecularWeight: 418.48164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC(=C(C(=C2)COC3=CC=C(C=C3)C(C)(C)C)O)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC(=C(C(=C2)COC3=CC=C(C=C3)C(C)(C)C)O)C(=O)O

InChI

InChI=1S/C26H26O5/c1-16(27)17-5-7-18(8-6-17)19-13-20(24(28)23(14-19)25(29)30)15-31-22-11-9-21(10-12-22)26(2,3)4/h5-14,28H,15H2,1-4H3,(H,29,30)