5-ethylsulfonyl-4-methoxy-2-methyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

Systemtic Name: 5-ethylsulfonyl-4-methoxy-2-methyl-2,3-dihydro-1-benzofuran-7-carboxylic acid Openeye Name: 5-ethylsulfonyl-4-methoxy-2-methyl-2,3-dihydrobenzofuran-7-carboxylic acid CAS Name: 5-ethylsulfonyl-4-methoxy-2-methyl-2,3-dihydrobenzofuran-7-carboxylic acid IUPAC Name: 5-ethylsulfonyl-4-methoxy-2-methyl-2,3-dihydro-1-benzofuran-7-carboxylic acid Traditional Name: 5-esyl-4-methoxy-2-methyl-coumaran-7-carboxylic acid Formula: C13H16O6S MolecularWeight: 300.32754

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C2=C(C(=C1)C(=O)O)OC(C2)C)OC

Isomeric SMILES

CCS(=O)(=O)C1=C(C2=C(C(=C1)C(=O)O)OC(C2)C)OC

InChI

InChI=1S/C13H16O6S/c1-4-20(16,17)10-6-9(13(14)15)11-8(12(10)18-3)5-7(2)19-11/h6-7H,4-5H2,1-3H3,(H,14,15)