(3,3-dimethyl-2-oxidanyl-2H-1-benzofuran-5-yl) ethanesulfonate

Systemtic Name: (3,3-dimethyl-2-oxidanyl-2H-1-benzofuran-5-yl) ethanesulfonate Openeye Name: (2-hydroxy-3,3-dimethyl-2H-benzofuran-5-yl) ethanesulfonate CAS Name: ethanesulfonic acid (2-hydroxy-3,3-dimethyl-2H-benzofuran-5-yl) ester IUPAC Name: (2-hydroxy-3,3-dimethyl-2H-1-benzofuran-5-yl) ethanesulfonate Traditional Name: ethanesulfonic acid (2-hydroxy-3,3-dimethyl-coumaran-5-yl) ester Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC2=C(C=C1)OC(C2(C)C)O

Isomeric SMILES

CCS(=O)(=O)OC1=CC2=C(C=C1)OC(C2(C)C)O

InChI

InChI=1S/C12H16O5S/c1-4-18(14,15)17-8-5-6-10-9(7-8)12(2,3)11(13)16-10/h5-7,11,13H,4H2,1-3H3