3-[2-(4-bromanyl-2-ethoxy-phenoxy)ethoxy]benzoic acid

Systemtic Name: 3-[2-(4-bromanyl-2-ethoxy-phenoxy)ethoxy]benzoic acid Openeye Name: 3-[2-(4-bromo-2-ethoxy-phenoxy)ethoxy]benzoic acid CAS Name: 3-[2-(4-bromo-2-ethoxyphenoxy)ethoxy]benzoic acid IUPAC Name: 3-[2-(4-bromo-2-ethoxyphenoxy)ethoxy]benzoic acid Traditional Name: 3-[2-(4-bromo-2-ethoxy-phenoxy)ethoxy]benzoic acid Formula: C17H17BrO5 MolecularWeight: 381.21788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)Br)OCCOC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)Br)OCCOC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C17H17BrO5/c1-2-21-16-11-13(18)6-7-15(16)23-9-8-22-14-5-3-4-12(10-14)17(19)20/h3-7,10-11H,2,8-9H2,1H3,(H,19,20)