ethyl (4R,4aS,8aR)-2,2-dimethyl-4-oxidanyl-7-oxidanylidene-3,4,8,8a-tetrahydrochromene-4a-carboxylate

Systemtic Name: ethyl (4R,4aS,8aR)-2,2-dimethyl-4-oxidanyl-7-oxidanylidene-3,4,8,8a-tetrahydrochromene-4a-carboxylate Openeye Name: ethyl (4R,4aS,8aR)-4-hydroxy-2,2-dimethyl-7-oxo-3,4,8,8a-tetrahydrochromene-4a-carboxylate CAS Name: (4R,4aS,8aR)-4-hydroxy-2,2-dimethyl-7-oxo-3,4,8,8a-tetrahydro-1-benzopyran-4a-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,4aS,8aR)-4-hydroxy-2,2-dimethyl-7-oxo-3,4,8,8a-tetrahydrochromene-4a-carboxylate Traditional Name: (4R,4aS,8aR)-4-hydroxy-7-keto-2,2-dimethyl-3,4,8,8a-tetrahydrochromene-4a-carboxylic acid ethyl ester Formula: C14H20O5 MolecularWeight: 268.3056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12C=CC(=O)CC1OC(CC2O)(C)C

Isomeric SMILES

CCOC(=O)[C@]12C=CC(=O)C[C@H]1OC(C[C@H]2O)(C)C

InChI

InChI=1S/C14H20O5/c1-4-18-12(17)14-6-5-9(15)7-11(14)19-13(2,3)8-10(14)16/h5-6,10-11,16H,4,7-8H2,1-3H3/t10-,11-,14+/m1/s1