ethyl 4,7-bis(bromanyl)-2-methylsulfanyl-5-oxidanyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 4,7-bis(bromanyl)-2-methylsulfanyl-5-oxidanyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 4,7-dibromo-5-hydroxy-2-methylsulfanyl-benzofuran-3-carboxylate CAS Name: 4,7-dibromo-5-hydroxy-2-(methylthio)-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4,7-dibromo-5-hydroxy-2-methylsulfanyl-1-benzofuran-3-carboxylate Traditional Name: 4,7-dibromo-5-hydroxy-2-(methylthio)benzofuran-3-carboxylic acid ethyl ester Formula: C12H10Br2O4S MolecularWeight: 410.0784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C=C(C(=C12)Br)O)Br)SC

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C=C(C(=C12)Br)O)Br)SC

InChI

InChI=1S/C12H10Br2O4S/c1-3-17-11(16)8-7-9(14)6(15)4-5(13)10(7)18-12(8)19-2/h4,15H,3H2,1-2H3