methylsulfonylmethyl 3-bromanyl-4-oxidanylidene-6-phenyl-pyran-2-carboxylate

Systemtic Name: methylsulfonylmethyl 3-bromanyl-4-oxidanylidene-6-phenyl-pyran-2-carboxylate Openeye Name: methylsulfonylmethyl 3-bromo-4-oxo-6-phenyl-pyran-2-carboxylate CAS Name: 3-bromo-4-oxo-6-phenyl-2-pyrancarboxylic acid methylsulfonylmethyl ester IUPAC Name: methylsulfonylmethyl 3-bromo-4-oxo-6-phenylpyran-2-carboxylate Traditional Name: 3-bromo-4-keto-6-phenyl-pyran-2-carboxylic acid mesylmethyl ester Formula: C14H11BrO6S MolecularWeight: 387.20254

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)COC(=O)C1=C(C(=O)C=C(O1)C2=CC=CC=C2)Br

Isomeric SMILES

CS(=O)(=O)COC(=O)C1=C(C(=O)C=C(O1)C2=CC=CC=C2)Br

InChI

InChI=1S/C14H11BrO6S/c1-22(18,19)8-20-14(17)13-12(15)10(16)7-11(21-13)9-5-3-2-4-6-9/h2-7H,8H2,1H3