4-[2-(2-bromanyl-4-ethyl-phenoxy)ethoxy]benzoate

Systemtic Name: 4-[2-(2-bromanyl-4-ethyl-phenoxy)ethoxy]benzoate Openeye Name: 4-[2-(2-bromo-4-ethyl-phenoxy)ethoxy]benzoate CAS Name: 4-[2-(2-bromo-4-ethylphenoxy)ethoxy]benzoate IUPAC Name: 4-[2-(2-bromo-4-ethylphenoxy)ethoxy]benzoate Traditional Name: 4-[2-(2-bromo-4-ethyl-phenoxy)ethoxy]benzoate Formula: C17H16BrO4- MolecularWeight: 364.21054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)[O-])Br

InChI

InChI=1S/C17H17BrO4/c1-2-12-3-8-16(15(18)11-12)22-10-9-21-14-6-4-13(5-7-14)17(19)20/h3-8,11H,2,9-10H2,1H3,(H,19,20)/p-1