3-chloranylsulfonyl-4,5-dimethoxy-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4,5-dimethoxy-benzoic acid Openeye Name: 3-chlorosulfonyl-4,5-dimethoxy-benzoic acid CAS Name: 3-chlorosulfonyl-4,5-dimethoxybenzoic acid IUPAC Name: 3-chlorosulfonyl-4,5-dimethoxybenzoic acid Traditional Name: 3-chlorosulfonyl-4,5-dimethoxy-benzoic acid Formula: C9H9ClO6S MolecularWeight: 280.68216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)Cl)OC

InChI

InChI=1S/C9H9ClO6S/c1-15-6-3-5(9(11)12)4-7(8(6)16-2)17(10,13)14/h3-4H,1-2H3,(H,11,12)