6-(4-bromophenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylic acid

Systemtic Name: 6-(4-bromophenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylic acid Openeye Name: 6-(4-bromophenyl)-4-methylsulfanyl-2-oxo-pyran-3-carboxylic acid CAS Name: 6-(4-bromophenyl)-4-(methylthio)-2-oxo-3-pyrancarboxylic acid IUPAC Name: 6-(4-bromophenyl)-4-methylsulfanyl-2-oxopyran-3-carboxylic acid Traditional Name: 6-(4-bromophenyl)-2-keto-4-(methylthio)pyran-3-carboxylic acid Formula: C13H9BrO4S MolecularWeight: 341.17716

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)OC(=C1)C2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CSC1=C(C(=O)OC(=C1)C2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C13H9BrO4S/c1-19-10-6-9(7-2-4-8(14)5-3-7)18-13(17)11(10)12(15)16/h2-6H,1H3,(H,15,16)