3-ethoxy-4-(2-ethylsulfonylethoxy)benzoic acid

Systemtic Name: 3-ethoxy-4-(2-ethylsulfonylethoxy)benzoic acid Openeye Name: 3-ethoxy-4-(2-ethylsulfonylethoxy)benzoic acid CAS Name: 3-ethoxy-4-(2-ethylsulfonylethoxy)benzoic acid IUPAC Name: 3-ethoxy-4-(2-ethylsulfonylethoxy)benzoic acid Traditional Name: 4-(2-esylethoxy)-3-ethoxy-benzoic acid Formula: C13H18O6S MolecularWeight: 302.34342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)O)OCCS(=O)(=O)CC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)O)OCCS(=O)(=O)CC

InChI

InChI=1S/C13H18O6S/c1-3-18-12-9-10(13(14)15)5-6-11(12)19-7-8-20(16,17)4-2/h5-6,9H,3-4,7-8H2,1-2H3,(H,14,15)