methyl (2R,4aS,5R,8aS)-2-methyl-5-oxidanyl-3-oxidanylidene-4a,5,8,8a-tetrahydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: methyl (2R,4aS,5R,8aS)-2-methyl-5-oxidanyl-3-oxidanylidene-4a,5,8,8a-tetrahydro-1,4-benzodioxine-7-carboxylate Openeye Name: methyl (2R,4aS,5R,8aS)-5-hydroxy-2-methyl-3-oxo-4a,5,8,8a-tetrahydro-1,4-benzodioxine-7-carboxylate CAS Name: (2R,4aS,5R,8aS)-5-hydroxy-2-methyl-3-oxo-4a,5,8,8a-tetrahydro-1,4-benzodioxin-7-carboxylic acid methyl ester IUPAC Name: methyl (2R,4aS,5R,8aS)-5-hydroxy-2-methyl-3-oxo-4a,5,8,8a-tetrahydro-1,4-benzodioxine-7-carboxylate Traditional Name: (2R,4aS,5R,8aS)-5-hydroxy-3-keto-2-methyl-4a,5,8,8a-tetrahydro-1,4-benzodioxin-7-carboxylic acid methyl ester Formula: C11H14O6 MolecularWeight: 242.22526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)OC2C(O1)CC(=CC2O)C(=O)OC

Isomeric SMILES

C[C@@H]1C(=O)O[C@@H]2[C@@H](O1)CC(=C[C@H]2O)C(=O)OC

InChI

InChI=1S/C11H14O6/c1-5-10(13)17-9-7(12)3-6(11(14)15-2)4-8(9)16-5/h3,5,7-9,12H,4H2,1-2H3/t5-,7-,8+,9+/m1/s1