2-(acetyloxymethoxysulfonyl)-2-(2,3-dihydro-1-benzofuran-5-yl)ethanoic acid

Systemtic Name: 2-(acetyloxymethoxysulfonyl)-2-(2,3-dihydro-1-benzofuran-5-yl)ethanoic acid Openeye Name: 2-(acetoxymethoxysulfonyl)-2-(2,3-dihydrobenzofuran-5-yl)acetic acid CAS Name: 2-(acetyloxymethoxysulfonyl)-2-(2,3-dihydrobenzofuran-5-yl)acetic acid IUPAC Name: 2-(acetyloxymethoxysulfonyl)-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid Traditional Name: 2-(acetoxymethoxysulfonyl)-2-coumaran-5-yl-acetic acid Formula: C13H14O8S MolecularWeight: 330.31046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOS(=O)(=O)C(C1=CC2=C(C=C1)OCC2)C(=O)O

Isomeric SMILES

CC(=O)OCOS(=O)(=O)C(C1=CC2=C(C=C1)OCC2)C(=O)O

InChI

InChI=1S/C13H14O8S/c1-8(14)20-7-21-22(17,18)12(13(15)16)10-2-3-11-9(6-10)4-5-19-11/h2-3,6,12H,4-5,7H2,1H3,(H,15,16)