3-(2-bromanyl-6-tert-butyl-4-methoxy-phenoxy)propanoic acid

Systemtic Name: 3-(2-bromanyl-6-tert-butyl-4-methoxy-phenoxy)propanoic acid Openeye Name: 3-(2-bromo-6-tert-butyl-4-methoxy-phenoxy)propanoic acid CAS Name: 3-(2-bromo-6-tert-butyl-4-methoxyphenoxy)propanoic acid IUPAC Name: 3-(2-bromo-6-tert-butyl-4-methoxyphenoxy)propanoic acid Traditional Name: 3-(2-bromo-6-tert-butyl-4-methoxy-phenoxy)propionic acid Formula: C14H19BrO4 MolecularWeight: 331.20226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OCCC(=O)O)Br)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OCCC(=O)O)Br)OC

InChI

InChI=1S/C14H19BrO4/c1-14(2,3)10-7-9(18-4)8-11(15)13(10)19-6-5-12(16)17/h7-8H,5-6H2,1-4H3,(H,16,17)