2-[4-[(2-bromanyl-4-ethyl-phenoxy)methyl]phenyl]ethanoate

Systemtic Name: 2-[4-[(2-bromanyl-4-ethyl-phenoxy)methyl]phenyl]ethanoate Openeye Name: 2-[4-[(2-bromo-4-ethyl-phenoxy)methyl]phenyl]acetate CAS Name: 2-[4-[(2-bromo-4-ethylphenoxy)methyl]phenyl]acetate IUPAC Name: 2-[4-[(2-bromo-4-ethylphenoxy)methyl]phenyl]acetate Traditional Name: 2-[4-[(2-bromo-4-ethyl-phenoxy)methyl]phenyl]acetate Formula: C17H16BrO3- MolecularWeight: 348.21114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC2=CC=C(C=C2)CC(=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC2=CC=C(C=C2)CC(=O)[O-])Br

InChI

InChI=1S/C17H17BrO3/c1-2-12-7-8-16(15(18)9-12)21-11-14-5-3-13(4-6-14)10-17(19)20/h3-9H,2,10-11H2,1H3,(H,19,20)/p-1