3,5-bis(methylsulfonyl)benzoate

Systemtic Name: 3,5-bis(methylsulfonyl)benzoate Openeye Name: 3,5-bis(methylsulfonyl)benzoate CAS Name: 3,5-bis(methylsulfonyl)benzoate IUPAC Name: 3,5-bis(methylsulfonyl)benzoate Traditional Name: 3,5-dimesylbenzoate Formula: C9H9O6S2- MolecularWeight: 277.29416

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC(=C1)C(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC(=C1)C(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C9H10O6S2/c1-16(12,13)7-3-6(9(10)11)4-8(5-7)17(2,14)15/h3-5H,1-2H3,(H,10,11)/p-1