2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoate

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoate Openeye Name: 2-(4-bromo-3,5-dimethyl-phenoxy)acetate CAS Name: 2-(4-bromo-3,5-dimethylphenoxy)acetate IUPAC Name: 2-(4-bromo-3,5-dimethylphenoxy)acetate Traditional Name: 2-(4-bromo-3,5-dimethyl-phenoxy)acetate Formula: C10H10BrO3- MolecularWeight: 258.0886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)OCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)OCC(=O)[O-]

InChI

InChI=1S/C10H11BrO3/c1-6-3-8(14-5-9(12)13)4-7(2)10(6)11/h3-4H,5H2,1-2H3,(H,12,13)/p-1