3-chloranyl-5-methoxy-4-thiophen-2-ylsulfonyloxy-benzoic acid

Systemtic Name: 3-chloranyl-5-methoxy-4-thiophen-2-ylsulfonyloxy-benzoic acid Openeye Name: 3-chloro-5-methoxy-4-(2-thienylsulfonyloxy)benzoic acid CAS Name: 3-chloro-5-methoxy-4-thiophen-2-ylsulfonyloxybenzoic acid IUPAC Name: 3-chloro-5-methoxy-4-thiophen-2-ylsulfonyloxybenzoic acid Traditional Name: 3-chloro-5-methoxy-4-(2-thienylsulfonyloxy)benzoic acid Formula: C12H9ClO6S2 MolecularWeight: 348.77926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=CS2

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C12H9ClO6S2/c1-18-9-6-7(12(14)15)5-8(13)11(9)19-21(16,17)10-3-2-4-20-10/h2-6H,1H3,(H,14,15)