methyl 3-chloranylsulfonyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 3-chloranylsulfonyl-5-methylsulfonyl-benzoate Openeye Name: methyl 3-chlorosulfonyl-5-methylsulfonyl-benzoate CAS Name: 3-chlorosulfonyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-chlorosulfonyl-5-methylsulfonylbenzoate Traditional Name: 3-chlorosulfonyl-5-mesyl-benzoic acid methyl ester Formula: C9H9ClO6S2 MolecularWeight: 312.74716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClO6S2/c1-16-9(11)6-3-7(17(2,12)13)5-8(4-6)18(10,14)15/h3-5H,1-2H3