2-[4-[(4-bromanyl-2-tert-butyl-phenoxy)methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(4-bromanyl-2-tert-butyl-phenoxy)methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[(4-bromo-2-tert-butyl-phenoxy)methyl]phenyl]acetic acid CAS Name: 2-[4-[(4-bromo-2-tert-butylphenoxy)methyl]phenyl]acetic acid IUPAC Name: 2-[4-[(4-bromo-2-tert-butylphenoxy)methyl]phenyl]acetic acid Traditional Name: 2-[4-[(4-bromo-2-tert-butyl-phenoxy)methyl]phenyl]acetic acid Formula: C19H21BrO3 MolecularWeight: 377.27224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrO3/c1-19(2,3)16-11-15(20)8-9-17(16)23-12-14-6-4-13(5-7-14)10-18(21)22/h4-9,11H,10,12H2,1-3H3,(H,21,22)