4-[(3,5-ditert-butyl-2-oxidanyl-phenoxy)methyl]benzoic acid

Systemtic Name: 4-[(3,5-ditert-butyl-2-oxidanyl-phenoxy)methyl]benzoic acid Openeye Name: 4-[(3,5-ditert-butyl-2-hydroxy-phenoxy)methyl]benzoic acid CAS Name: 4-[(3,5-ditert-butyl-2-hydroxyphenoxy)methyl]benzoic acid IUPAC Name: 4-[(3,5-ditert-butyl-2-hydroxyphenoxy)methyl]benzoic acid Traditional Name: 4-[(3,5-ditert-butyl-2-hydroxy-phenoxy)methyl]benzoic acid Formula: C22H28O4 MolecularWeight: 356.45532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)OCC2=CC=C(C=C2)C(=O)O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)OCC2=CC=C(C=C2)C(=O)O)O)C(C)(C)C

InChI

InChI=1S/C22H28O4/c1-21(2,3)16-11-17(22(4,5)6)19(23)18(12-16)26-13-14-7-9-15(10-8-14)20(24)25/h7-12,23H,13H2,1-6H3,(H,24,25)