methyl 2-[5-(4-bromanylphenoxy)-2-methylsulfanyl-phenoxy]ethanoate

Systemtic Name: methyl 2-[5-(4-bromanylphenoxy)-2-methylsulfanyl-phenoxy]ethanoate Openeye Name: methyl 2-[5-(4-bromophenoxy)-2-methylsulfanyl-phenoxy]acetate CAS Name: 2-[5-(4-bromophenoxy)-2-(methylthio)phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[5-(4-bromophenoxy)-2-methylsulfanylphenoxy]acetate Traditional Name: 2-[5-(4-bromophenoxy)-2-(methylthio)phenoxy]acetic acid methyl ester Formula: C16H15BrO4S MolecularWeight: 383.2569

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=C(C=CC(=C1)OC2=CC=C(C=C2)Br)SC

Isomeric SMILES

COC(=O)COC1=C(C=CC(=C1)OC2=CC=C(C=C2)Br)SC

InChI

InChI=1S/C16H15BrO4S/c1-19-16(18)10-20-14-9-13(7-8-15(14)22-2)21-12-5-3-11(17)4-6-12/h3-9H,10H2,1-2H3