methyl 2-chloranyl-4-methylsulfonyl-3-oxidanyl-benzoate

Systemtic Name: methyl 2-chloranyl-4-methylsulfonyl-3-oxidanyl-benzoate Openeye Name: methyl 2-chloro-3-hydroxy-4-methylsulfonyl-benzoate CAS Name: 2-chloro-3-hydroxy-4-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-chloro-3-hydroxy-4-methylsulfonylbenzoate Traditional Name: 2-chloro-3-hydroxy-4-mesyl-benzoic acid methyl ester Formula: C9H9ClO5S MolecularWeight: 264.68276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClO5S/c1-15-9(12)5-3-4-6(16(2,13)14)8(11)7(5)10/h3-4,11H,1-2H3