4-[2-(4-bromanyl-2,6-dimethoxy-phenoxy)ethoxy]benzoate

Systemtic Name: 4-[2-(4-bromanyl-2,6-dimethoxy-phenoxy)ethoxy]benzoate Openeye Name: 4-[2-(4-bromo-2,6-dimethoxy-phenoxy)ethoxy]benzoate CAS Name: 4-[2-(4-bromo-2,6-dimethoxyphenoxy)ethoxy]benzoate IUPAC Name: 4-[2-(4-bromo-2,6-dimethoxyphenoxy)ethoxy]benzoate Traditional Name: 4-[2-(4-bromo-2,6-dimethoxy-phenoxy)ethoxy]benzoate Formula: C17H16BrO6- MolecularWeight: 396.20934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCCOC2=CC=C(C=C2)C(=O)[O-])OC)Br

Isomeric SMILES

COC1=CC(=CC(=C1OCCOC2=CC=C(C=C2)C(=O)[O-])OC)Br

InChI

InChI=1S/C17H17BrO6/c1-21-14-9-12(18)10-15(22-2)16(14)24-8-7-23-13-5-3-11(4-6-13)17(19)20/h3-6,9-10H,7-8H2,1-2H3,(H,19,20)/p-1