2-[4-[2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonylamino]ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonylamino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(3,5-ditert-butyl-4-hydroxy-benzoyl)amino]ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethyl]amino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(3,5-ditert-butyl-4-hydroxybenzoyl)amino]ethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(3,5-ditert-butyl-4-hydroxy-benzoyl)amino]ethyl]phenoxy]acetic acid Formula: C25H33NO5 MolecularWeight: 427.53322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NCCC2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NCCC2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C25H33NO5/c1-24(2,3)19-13-17(14-20(22(19)29)25(4,5)6)23(30)26-12-11-16-7-9-18(10-8-16)31-15-21(27)28/h7-10,13-14,29H,11-12,15H2,1-6H3,(H,26,30)(H,27,28)