[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 5-bromanylfuran-2-carboxylate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 5-bromanylfuran-2-carboxylate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C14H11BrO4S MolecularWeight: 355.20374

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C14H11BrO4S/c1-20-10-4-2-9(3-5-10)11(16)8-18-14(17)12-6-7-13(15)19-12/h2-7H,8H2,1H3