5-[(E)-3-chloranylprop-2-enyl]sulfonyl-2,3-dimethoxy-benzoic acid

Systemtic Name: 5-[(E)-3-chloranylprop-2-enyl]sulfonyl-2,3-dimethoxy-benzoic acid Openeye Name: 5-[(E)-3-chloroallyl]sulfonyl-2,3-dimethoxy-benzoic acid CAS Name: 5-[(E)-3-chloroprop-2-enyl]sulfonyl-2,3-dimethoxybenzoic acid IUPAC Name: 5-[(E)-3-chloroprop-2-enyl]sulfonyl-2,3-dimethoxybenzoic acid Traditional Name: 5-[(E)-3-chloroallyl]sulfonyl-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=CCl)C(=O)O)OC

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClO6S/c1-18-10-7-8(20(16,17)5-3-4-13)6-9(12(14)15)11(10)19-2/h3-4,6-7H,5H2,1-2H3,(H,14,15)/b4-3+