5-(2-chloranylprop-2-enylsulfonyl)-2,3-dimethoxy-benzoic acid

Systemtic Name: 5-(2-chloranylprop-2-enylsulfonyl)-2,3-dimethoxy-benzoic acid Openeye Name: 5-(2-chloroallylsulfonyl)-2,3-dimethoxy-benzoic acid CAS Name: 5-(2-chloroprop-2-enylsulfonyl)-2,3-dimethoxybenzoic acid IUPAC Name: 5-(2-chloroprop-2-enylsulfonyl)-2,3-dimethoxybenzoic acid Traditional Name: 5-(2-chloroallylsulfonyl)-2,3-dimethoxy-benzoic acid Formula: C12H13ClO6S MolecularWeight: 320.74602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClO6S/c1-7(13)6-20(16,17)8-4-9(12(14)15)11(19-3)10(5-8)18-2/h4-5H,1,6H2,2-3H3,(H,14,15)