methyl (2S,3R)-6-chloranyl-3-methyl-3-oxidanyl-2H-1-benzofuran-2-carboxylate

Systemtic Name: methyl (2S,3R)-6-chloranyl-3-methyl-3-oxidanyl-2H-1-benzofuran-2-carboxylate Openeye Name: methyl (2S,3R)-6-chloro-3-hydroxy-3-methyl-2H-benzofuran-2-carboxylate CAS Name: (2S,3R)-6-chloro-3-hydroxy-3-methyl-2H-benzofuran-2-carboxylic acid methyl ester IUPAC Name: methyl (2S,3R)-6-chloro-3-hydroxy-3-methyl-2H-1-benzofuran-2-carboxylate Traditional Name: (2S,3R)-6-chloro-3-hydroxy-3-methyl-coumaran-2-carboxylic acid methyl ester Formula: C11H11ClO4 MolecularWeight: 242.65564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=C1C=CC(=C2)Cl)C(=O)OC)O

Isomeric SMILES

C[C@@]1([C@H](OC2=C1C=CC(=C2)Cl)C(=O)OC)O

InChI

InChI=1S/C11H11ClO4/c1-11(14)7-4-3-6(12)5-8(7)16-9(11)10(13)15-2/h3-5,9,14H,1-2H3/t9-,11-/m1/s1