methyl 6-(4-bromophenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate

Systemtic Name: methyl 6-(4-bromophenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate Openeye Name: methyl 6-(4-bromophenyl)-4-methylsulfanyl-2-oxo-pyran-3-carboxylate CAS Name: 6-(4-bromophenyl)-4-(methylthio)-2-oxo-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 6-(4-bromophenyl)-4-methylsulfanyl-2-oxopyran-3-carboxylate Traditional Name: 6-(4-bromophenyl)-2-keto-4-(methylthio)pyran-3-carboxylic acid methyl ester Formula: C14H11BrO4S MolecularWeight: 355.20374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(OC1=O)C2=CC=C(C=C2)Br)SC

Isomeric SMILES

COC(=O)C1=C(C=C(OC1=O)C2=CC=C(C=C2)Br)SC

InChI

InChI=1S/C14H11BrO4S/c1-18-13(16)12-11(20-2)7-10(19-14(12)17)8-3-5-9(15)6-4-8/h3-7H,1-2H3