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

Systemtic Name: (3,3-dimethyl-2H-1-benzofuran-5-yl) ethanesulfonate Openeye Name: (3,3-dimethyl-2H-benzofuran-5-yl) ethanesulfonate CAS Name: ethanesulfonic acid (3,3-dimethyl-2H-benzofuran-5-yl) ester IUPAC Name: (3,3-dimethyl-2H-1-benzofuran-5-yl) ethanesulfonate Traditional Name: ethanesulfonic acid (3,3-dimethylcoumaran-5-yl) ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC2=C(C=C1)OCC2(C)C

Isomeric SMILES

CCS(=O)(=O)OC1=CC2=C(C=C1)OCC2(C)C

InChI

InChI=1S/C12H16O4S/c1-4-17(13,14)16-9-5-6-11-10(7-9)12(2,3)8-15-11/h5-7H,4,8H2,1-3H3