ethyl (2S)-2-methyl-5-oxidanyl-3H-1-benzofuran-2-carboxylate

Systemtic Name: ethyl (2S)-2-methyl-5-oxidanyl-3H-1-benzofuran-2-carboxylate Openeye Name: ethyl (2S)-5-hydroxy-2-methyl-3H-benzofuran-2-carboxylate CAS Name: (2S)-5-hydroxy-2-methyl-3H-benzofuran-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2S)-5-hydroxy-2-methyl-3H-1-benzofuran-2-carboxylate Traditional Name: (2S)-5-hydroxy-2-methyl-coumaran-2-carboxylic acid ethyl ester Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=C(O1)C=CC(=C2)O)C

Isomeric SMILES

CCOC(=O)[C@@]1(CC2=C(O1)C=CC(=C2)O)C

InChI

InChI=1S/C12H14O4/c1-3-15-11(14)12(2)7-8-6-9(13)4-5-10(8)16-12/h4-6,13H,3,7H2,1-2H3/t12-/m0/s1