(2-bromanyl-6-methylsulfanyl-phenyl) ethanoate

Systemtic Name: (2-bromanyl-6-methylsulfanyl-phenyl) ethanoate Openeye Name: (2-bromo-6-methylsulfanyl-phenyl) acetate CAS Name: acetic acid [2-bromo-6-(methylthio)phenyl] ester IUPAC Name: (2-bromo-6-methylsulfanylphenyl) acetate Traditional Name: acetic acid [2-bromo-6-(methylthio)phenyl] ester Formula: C9H9BrO2S MolecularWeight: 261.13556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC=C1Br)SC

Isomeric SMILES

CC(=O)OC1=C(C=CC=C1Br)SC

InChI

InChI=1S/C9H9BrO2S/c1-6(11)12-9-7(10)4-3-5-8(9)13-2/h3-5H,1-2H3