methyl 3-bromanyl-4-methylsulfonyl-benzoate

Systemtic Name: methyl 3-bromanyl-4-methylsulfonyl-benzoate Openeye Name: methyl 3-bromo-4-methylsulfonyl-benzoate CAS Name: 3-bromo-4-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-methylsulfonylbenzoate Traditional Name: 3-bromo-4-mesyl-benzoic acid methyl ester Formula: C9H9BrO4S MolecularWeight: 293.13436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)C)Br

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)C)Br

InChI

InChI=1S/C9H9BrO4S/c1-14-9(11)6-3-4-8(7(10)5-6)15(2,12)13/h3-5H,1-2H3