ethyl 4-oxidanyl-7-oxidanylidene-5,6,8,8a-tetrahydrochromene-2-carboxylate

Systemtic Name: ethyl 4-oxidanyl-7-oxidanylidene-5,6,8,8a-tetrahydrochromene-2-carboxylate Openeye Name: ethyl 4-hydroxy-7-oxo-5,6,8,8a-tetrahydrochromene-2-carboxylate CAS Name: 4-hydroxy-7-oxo-5,6,8,8a-tetrahydro-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-7-oxo-5,6,8,8a-tetrahydrochromene-2-carboxylate Traditional Name: 4-hydroxy-7-keto-5,6,8,8a-tetrahydrochromene-2-carboxylic acid ethyl ester Formula: C12H14O5 MolecularWeight: 238.23656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2CCC(=O)CC2O1)O

Isomeric SMILES

CCOC(=O)C1=CC(=C2CCC(=O)CC2O1)O

InChI

InChI=1S/C12H14O5/c1-2-16-12(15)11-6-9(14)8-4-3-7(13)5-10(8)17-11/h6,10,14H,2-5H2,1H3